USER MOD reduce.3.24.130724 H: found=0, std=0, add=1129, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 1127 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 92 GLN : amide:sc= 1.22 K(o=2.1,f=-0.52) USER MOD Set 1.2: A 133 HIS : no HD1:sc= 0.847 K(o=2.1,f=-1.7) USER MOD Set 2.1: A 66 GLN : amide:sc= 0.149 X(o=0.46,f=-0.038) USER MOD Set 2.2: A 70 GLN : amide:sc= 0.312 X(o=0.46,f=-0.038) USER MOD Set 3.1: A 22 SER OG : rot -164:sc= 0.959 USER MOD Set 3.2: A 62 HIS : no HD1:sc= 1.03 K(o=2,f=-2.5) USER MOD Set 4.1: A 5 THR OG1 : rot 71:sc= 0.196 USER MOD Set 4.2: A 38 MET CE :methyl -152:sc= -0.0672 (180deg=-0.924) USER MOD Set 5.1: A 14 SER OG : rot 180:sc= 1.02 USER MOD Set 5.2: A 17 SER OG : rot -90:sc= 1.08 USER MOD Set 6.1: A 3 GLN : amide:sc= 0.524 K(o=0.93,f=-2.6) USER MOD Set 6.2: A 28 GLN : amide:sc= 0.409 K(o=0.93,f=-1.4) USER MOD Single : A 1 SER N :NH3+ -177:sc= 1.32 (180deg=1.27) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot -78:sc= 1.24 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 ASN : amide:sc= 0.612 K(o=0.61,f=-4.6!) USER MOD Single : A 10 THR OG1 : rot -62:sc= 1.22 USER MOD Single : A 15 GLN : amide:sc= -0.0676 X(o=-0.068,f=-0.15) USER MOD Single : A 19 SER OG : rot -29:sc= 0.646 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 TYR OH : rot 180:sc= 0.0845 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 TYR OH : rot 150:sc= -0.312 USER MOD Single : A 43 MET CE :methyl -176:sc= -1.13 (180deg=-1.18) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 49 ASN : amide:sc= -0.477! C(o=-0.48!,f=-11!) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 1.23 (180deg=1.23) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 MET CE :methyl 161:sc= -0.0527 (180deg=-0.405) USER MOD Single : A 61 ASN : amide:sc= -0.97 K(o=-0.97,f=-3.1!) USER MOD Single : A 65 GLN : amide:sc= 0 K(o=0,f=-0.91) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 1.04 (180deg=1.04) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 GLN : amide:sc= -0.0781 X(o=-0.078,f=-0.26) USER MOD Single : A 76 GLN : amide:sc= 0.417 K(o=0.42,f=-0.085) USER MOD Single : A 78 SER OG : rot 148:sc= 1.24 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 ASN : amide:sc= -0.365 K(o=-0.37,f=-1.2) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 SER OG : rot -64:sc= 1.26 USER MOD Single : A 107 ASN : amide:sc= -0.0882 K(o=-0.088,f=-1.8!) USER MOD Single : A 110 LYS NZ :NH3+ -173:sc= 1.24 (180deg=1.19) USER MOD Single : A 113 ASN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 116 SER OG : rot 180:sc= -0.215 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 GLN : amide:sc= 0.295 X(o=0.29,f=-0.2) USER MOD Single : A 121 ASN : amide:sc= -0.072 K(o=-0.072,f=-1.6!) USER MOD Single : A 126 SER OG : rot 82:sc= 1.09 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 2.798 -2.471 0.789 1.00 0.00 N ATOM 2 CA SER A 1 2.265 -1.748 -0.360 1.00 0.00 C ATOM 3 C SER A 1 2.939 -0.391 -0.517 1.00 0.00 C ATOM 4 O SER A 1 3.097 0.108 -1.631 1.00 0.00 O ATOM 5 CB SER A 1 0.767 -1.565 -0.211 1.00 0.00 C ATOM 6 OG SER A 1 0.469 -0.730 0.875 1.00 0.00 O ATOM 0 H1 SER A 1 2.358 -3.412 0.842 1.00 0.00 H new ATOM 0 H2 SER A 1 3.828 -2.576 0.686 1.00 0.00 H new ATOM 0 H3 SER A 1 2.589 -1.942 1.660 1.00 0.00 H new ATOM 0 HA SER A 1 2.470 -2.337 -1.254 1.00 0.00 H new ATOM 0 HB2 SER A 1 0.356 -1.138 -1.126 1.00 0.00 H new ATOM 0 HB3 SER A 1 0.291 -2.535 -0.070 1.00 0.00 H new ATOM 0 HG SER A 1 -0.502 -0.625 0.950 1.00 0.00 H new ATOM 14 N GLU A 2 3.334 0.201 0.604 1.00 0.00 N ATOM 15 CA GLU A 2 3.896 1.547 0.603 1.00 0.00 C ATOM 16 C GLU A 2 5.253 1.577 -0.087 1.00 0.00 C ATOM 17 O GLU A 2 5.706 2.627 -0.542 1.00 0.00 O ATOM 18 CB GLU A 2 4.029 2.071 2.035 1.00 0.00 C ATOM 19 CG GLU A 2 4.920 1.225 2.933 1.00 0.00 C ATOM 20 CD GLU A 2 4.227 -0.004 3.454 1.00 0.00 C ATOM 21 OE1 GLU A 2 3.324 -0.474 2.805 1.00 0.00 O ATOM 22 OE2 GLU A 2 4.601 -0.472 4.503 1.00 0.00 O ATOM 0 H GLU A 2 3.276 -0.230 1.527 1.00 0.00 H new ATOM 0 HA GLU A 2 3.215 2.192 0.048 1.00 0.00 H new ATOM 0 HB2 GLU A 2 4.425 3.086 2.002 1.00 0.00 H new ATOM 0 HB3 GLU A 2 3.036 2.131 2.481 1.00 0.00 H new ATOM 0 HG2 GLU A 2 5.809 0.927 2.377 1.00 0.00 H new ATOM 0 HG3 GLU A 2 5.258 1.830 3.775 1.00 0.00 H new ATOM 29 N GLN A 3 5.899 0.418 -0.163 1.00 0.00 N ATOM 30 CA GLN A 3 7.173 0.294 -0.860 1.00 0.00 C ATOM 31 C GLN A 3 7.027 0.631 -2.338 1.00 0.00 C ATOM 32 O GLN A 3 7.967 1.113 -2.971 1.00 0.00 O ATOM 33 CB GLN A 3 7.738 -1.120 -0.699 1.00 0.00 C ATOM 34 CG GLN A 3 8.204 -1.448 0.709 1.00 0.00 C ATOM 35 CD GLN A 3 8.661 -2.887 0.847 1.00 0.00 C ATOM 36 OE1 GLN A 3 8.337 -3.739 0.015 1.00 0.00 O ATOM 37 NE2 GLN A 3 9.420 -3.168 1.900 1.00 0.00 N ATOM 0 H GLN A 3 5.560 -0.450 0.251 1.00 0.00 H new ATOM 0 HA GLN A 3 7.867 1.006 -0.413 1.00 0.00 H new ATOM 0 HB2 GLN A 3 6.975 -1.840 -0.994 1.00 0.00 H new ATOM 0 HB3 GLN A 3 8.576 -1.245 -1.385 1.00 0.00 H new ATOM 0 HG2 GLN A 3 9.023 -0.782 0.982 1.00 0.00 H new ATOM 0 HG3 GLN A 3 7.392 -1.259 1.411 1.00 0.00 H new ATOM 0 HE21 GLN A 3 9.664 -2.433 2.563 1.00 0.00 H new ATOM 0 HE22 GLN A 3 9.759 -4.119 2.045 1.00 0.00 H new ATOM 46 N PHE A 4 5.844 0.373 -2.884 1.00 0.00 N ATOM 47 CA PHE A 4 5.536 0.750 -4.259 1.00 0.00 C ATOM 48 C PHE A 4 4.887 2.127 -4.321 1.00 0.00 C ATOM 49 O PHE A 4 5.246 2.956 -5.157 1.00 0.00 O ATOM 50 CB PHE A 4 4.611 -0.285 -4.902 1.00 0.00 C ATOM 51 CG PHE A 4 4.174 0.074 -6.294 1.00 0.00 C ATOM 52 CD1 PHE A 4 5.014 -0.140 -7.376 1.00 0.00 C ATOM 53 CD2 PHE A 4 2.924 0.628 -6.523 1.00 0.00 C ATOM 54 CE1 PHE A 4 4.613 0.190 -8.657 1.00 0.00 C ATOM 55 CE2 PHE A 4 2.520 0.958 -7.802 1.00 0.00 C ATOM 56 CZ PHE A 4 3.367 0.739 -8.870 1.00 0.00 C ATOM 0 H PHE A 4 5.082 -0.096 -2.395 1.00 0.00 H new ATOM 0 HA PHE A 4 6.475 0.786 -4.811 1.00 0.00 H new ATOM 0 HB2 PHE A 4 5.121 -1.248 -4.928 1.00 0.00 H new ATOM 0 HB3 PHE A 4 3.728 -0.409 -4.275 1.00 0.00 H new ATOM 0 HD1 PHE A 4 5.992 -0.569 -7.216 1.00 0.00 H new ATOM 0 HD2 PHE A 4 2.258 0.804 -5.691 1.00 0.00 H new ATOM 0 HE1 PHE A 4 5.277 0.017 -9.491 1.00 0.00 H new ATOM 0 HE2 PHE A 4 1.543 1.387 -7.966 1.00 0.00 H new ATOM 0 HZ PHE A 4 3.054 0.997 -9.871 1.00 0.00 H new ATOM 66 N THR A 5 3.929 2.364 -3.431 1.00 0.00 N ATOM 67 CA THR A 5 3.105 3.565 -3.495 1.00 0.00 C ATOM 68 C THR A 5 3.958 4.824 -3.418 1.00 0.00 C ATOM 69 O THR A 5 3.749 5.776 -4.170 1.00 0.00 O ATOM 70 CB THR A 5 2.058 3.580 -2.366 1.00 0.00 C ATOM 71 OG1 THR A 5 1.200 2.438 -2.492 1.00 0.00 O ATOM 72 CG2 THR A 5 1.220 4.847 -2.432 1.00 0.00 C ATOM 0 H THR A 5 3.704 1.740 -2.656 1.00 0.00 H new ATOM 0 HA THR A 5 2.588 3.550 -4.455 1.00 0.00 H new ATOM 0 HB THR A 5 2.578 3.550 -1.409 1.00 0.00 H new ATOM 0 HG1 THR A 5 1.699 1.627 -2.260 1.00 0.00 H new ATOM 0 HG21 THR A 5 0.486 4.840 -1.627 1.00 0.00 H new ATOM 0 HG22 THR A 5 1.867 5.717 -2.325 1.00 0.00 H new ATOM 0 HG23 THR A 5 0.705 4.893 -3.392 1.00 0.00 H new ATOM 80 N THR A 6 4.922 4.824 -2.503 1.00 0.00 N ATOM 81 CA THR A 6 5.782 5.983 -2.296 1.00 0.00 C ATOM 82 C THR A 6 6.733 6.180 -3.469 1.00 0.00 C ATOM 83 O THR A 6 7.207 7.288 -3.717 1.00 0.00 O ATOM 84 CB THR A 6 6.590 5.848 -0.992 1.00 0.00 C ATOM 85 OG1 THR A 6 7.392 4.661 -1.044 1.00 0.00 O ATOM 86 CG2 THR A 6 5.658 5.773 0.208 1.00 0.00 C ATOM 0 H THR A 6 5.127 4.033 -1.892 1.00 0.00 H new ATOM 0 HA THR A 6 5.134 6.856 -2.220 1.00 0.00 H new ATOM 0 HB THR A 6 7.231 6.724 -0.888 1.00 0.00 H new ATOM 0 HG1 THR A 6 6.830 3.878 -0.866 1.00 0.00 H new ATOM 0 HG21 THR A 6 6.247 5.678 1.120 1.00 0.00 H new ATOM 0 HG22 THR A 6 5.055 6.680 0.258 1.00 0.00 H new ATOM 0 HG23 THR A 6 5.003 4.907 0.107 1.00 0.00 H new ATOM 94 N LYS A 7 7.009 5.097 -4.188 1.00 0.00 N ATOM 95 CA LYS A 7 7.854 5.161 -5.375 1.00 0.00 C ATOM 96 C LYS A 7 7.049 5.560 -6.604 1.00 0.00 C ATOM 97 O LYS A 7 7.570 6.194 -7.521 1.00 0.00 O ATOM 98 CB LYS A 7 8.546 3.817 -5.612 1.00 0.00 C ATOM 99 CG LYS A 7 9.495 3.393 -4.499 1.00 0.00 C ATOM 100 CD LYS A 7 10.651 4.370 -4.355 1.00 0.00 C ATOM 101 CE LYS A 7 11.631 3.917 -3.284 1.00 0.00 C ATOM 102 NZ LYS A 7 12.741 4.890 -3.096 1.00 0.00 N ATOM 0 H LYS A 7 6.660 4.164 -3.969 1.00 0.00 H new ATOM 0 HA LYS A 7 8.613 5.925 -5.203 1.00 0.00 H new ATOM 0 HB2 LYS A 7 7.785 3.047 -5.737 1.00 0.00 H new ATOM 0 HB3 LYS A 7 9.103 3.869 -6.548 1.00 0.00 H new ATOM 0 HG2 LYS A 7 8.949 3.331 -3.557 1.00 0.00 H new ATOM 0 HG3 LYS A 7 9.883 2.396 -4.709 1.00 0.00 H new ATOM 0 HD2 LYS A 7 11.170 4.465 -5.309 1.00 0.00 H new ATOM 0 HD3 LYS A 7 10.265 5.358 -4.103 1.00 0.00 H new ATOM 0 HE2 LYS A 7 11.101 3.785 -2.341 1.00 0.00 H new ATOM 0 HE3 LYS A 7 12.043 2.946 -3.557 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 13.386 4.543 -2.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 13.263 4.998 -3.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 12.351 5.811 -2.810 1.00 0.00 H new ATOM 116 N LEU A 8 5.774 5.184 -6.618 1.00 0.00 N ATOM 117 CA LEU A 8 4.856 5.628 -7.660 1.00 0.00 C ATOM 118 C LEU A 8 4.617 7.130 -7.579 1.00 0.00 C ATOM 119 O LEU A 8 4.670 7.832 -8.589 1.00 0.00 O ATOM 120 CB LEU A 8 3.520 4.884 -7.540 1.00 0.00 C ATOM 121 CG LEU A 8 2.444 5.280 -8.560 1.00 0.00 C ATOM 122 CD1 LEU A 8 2.948 4.993 -9.968 1.00 0.00 C ATOM 123 CD2 LEU A 8 1.163 4.513 -8.270 1.00 0.00 C ATOM 0 H LEU A 8 5.353 4.572 -5.919 1.00 0.00 H new ATOM 0 HA LEU A 8 5.310 5.404 -8.625 1.00 0.00 H new ATOM 0 HB2 LEU A 8 3.710 3.815 -7.637 1.00 0.00 H new ATOM 0 HB3 LEU A 8 3.123 5.048 -6.538 1.00 0.00 H new ATOM 0 HG LEU A 8 2.231 6.346 -8.482 1.00 0.00 H new ATOM 0 HD11 LEU A 8 2.184 5.274 -10.692 1.00 0.00 H new ATOM 0 HD12 LEU A 8 3.854 5.569 -10.155 1.00 0.00 H new ATOM 0 HD13 LEU A 8 3.167 3.930 -10.066 1.00 0.00 H new ATOM 0 HD21 LEU A 8 0.399 4.794 -8.994 1.00 0.00 H new ATOM 0 HD22 LEU A 8 1.355 3.443 -8.343 1.00 0.00 H new ATOM 0 HD23 LEU A 8 0.816 4.752 -7.265 1.00 0.00 H new ATOM 135 N ASN A 9 4.353 7.618 -6.372 1.00 0.00 N ATOM 136 CA ASN A 9 4.110 9.040 -6.157 1.00 0.00 C ATOM 137 C ASN A 9 5.333 9.869 -6.526 1.00 0.00 C ATOM 138 O ASN A 9 5.212 11.027 -6.927 1.00 0.00 O ATOM 139 CB ASN A 9 3.704 9.300 -4.718 1.00 0.00 C ATOM 140 CG ASN A 9 2.292 8.869 -4.429 1.00 0.00 C ATOM 141 OD1 ASN A 9 1.456 8.793 -5.336 1.00 0.00 O ATOM 142 ND2 ASN A 9 2.012 8.586 -3.183 1.00 0.00 N ATOM 0 H ASN A 9 4.302 7.049 -5.527 1.00 0.00 H new ATOM 0 HA ASN A 9 3.290 9.343 -6.809 1.00 0.00 H new ATOM 0 HB2 ASN A 9 4.385 8.772 -4.051 1.00 0.00 H new ATOM 0 HB3 ASN A 9 3.807 10.363 -4.502 1.00 0.00 H new ATOM 0 HD21 ASN A 9 1.071 8.288 -2.927 1.00 0.00 H new ATOM 0 HD22 ASN A 9 2.735 8.663 -2.468 1.00 0.00 H new ATOM 149 N THR A 10 6.511 9.270 -6.390 1.00 0.00 N ATOM 150 CA THR A 10 7.759 9.949 -6.721 1.00 0.00 C ATOM 151 C THR A 10 8.423 9.318 -7.938 1.00 0.00 C ATOM 152 O THR A 10 9.645 9.354 -8.079 1.00 0.00 O ATOM 153 CB THR A 10 8.735 9.927 -5.530 1.00 0.00 C ATOM 154 OG1 THR A 10 9.012 8.569 -5.161 1.00 0.00 O ATOM 155 CG2 THR A 10 8.139 10.661 -4.339 1.00 0.00 C ATOM 0 H THR A 10 6.628 8.315 -6.052 1.00 0.00 H new ATOM 0 HA THR A 10 7.511 10.984 -6.954 1.00 0.00 H new ATOM 0 HB THR A 10 9.658 10.426 -5.826 1.00 0.00 H new ATOM 0 HG1 THR A 10 8.183 8.132 -4.876 1.00 0.00 H new ATOM 0 HG21 THR A 10 8.842 10.635 -3.507 1.00 0.00 H new ATOM 0 HG22 THR A 10 7.939 11.697 -4.613 1.00 0.00 H new ATOM 0 HG23 THR A 10 7.208 10.178 -4.042 1.00 0.00 H new ATOM 163 N LEU A 11 7.610 8.741 -8.817 1.00 0.00 N ATOM 164 CA LEU A 11 8.115 8.128 -10.040 1.00 0.00 C ATOM 165 C LEU A 11 8.642 9.181 -11.007 1.00 0.00 C ATOM 166 O LEU A 11 7.895 10.044 -11.467 1.00 0.00 O ATOM 167 CB LEU A 11 7.008 7.310 -10.718 1.00 0.00 C ATOM 168 CG LEU A 11 7.431 6.528 -11.968 1.00 0.00 C ATOM 169 CD1 LEU A 11 8.432 5.448 -11.578 1.00 0.00 C ATOM 170 CD2 LEU A 11 6.201 5.921 -12.627 1.00 0.00 C ATOM 0 H LEU A 11 6.598 8.685 -8.705 1.00 0.00 H new ATOM 0 HA LEU A 11 8.939 7.468 -9.769 1.00 0.00 H new ATOM 0 HB2 LEU A 11 6.604 6.606 -9.990 1.00 0.00 H new ATOM 0 HB3 LEU A 11 6.198 7.986 -10.991 1.00 0.00 H new ATOM 0 HG LEU A 11 7.909 7.198 -12.683 1.00 0.00 H new ATOM 0 HD11 LEU A 11 8.732 4.892 -12.466 1.00 0.00 H new ATOM 0 HD12 LEU A 11 9.309 5.911 -11.126 1.00 0.00 H new ATOM 0 HD13 LEU A 11 7.972 4.767 -10.862 1.00 0.00 H new ATOM 0 HD21 LEU A 11 6.501 5.365 -13.515 1.00 0.00 H new ATOM 0 HD22 LEU A 11 5.708 5.247 -11.926 1.00 0.00 H new ATOM 0 HD23 LEU A 11 5.511 6.716 -12.912 1.00 0.00 H new ATOM 182 N GLU A 12 9.933 9.103 -11.311 1.00 0.00 N ATOM 183 CA GLU A 12 10.566 10.060 -12.211 1.00 0.00 C ATOM 184 C GLU A 12 10.952 9.404 -13.530 1.00 0.00 C ATOM 185 O GLU A 12 10.960 8.178 -13.645 1.00 0.00 O ATOM 186 CB GLU A 12 11.805 10.671 -11.553 1.00 0.00 C ATOM 187 CG GLU A 12 11.511 11.523 -10.326 1.00 0.00 C ATOM 188 CD GLU A 12 10.748 12.777 -10.655 1.00 0.00 C ATOM 189 OE1 GLU A 12 11.027 13.371 -11.668 1.00 0.00 O ATOM 190 OE2 GLU A 12 9.885 13.140 -9.891 1.00 0.00 O ATOM 0 H GLU A 12 10.562 8.387 -10.947 1.00 0.00 H new ATOM 0 HA GLU A 12 9.844 10.850 -12.419 1.00 0.00 H new ATOM 0 HB2 GLU A 12 12.483 9.867 -11.268 1.00 0.00 H new ATOM 0 HB3 GLU A 12 12.327 11.283 -12.288 1.00 0.00 H new ATOM 0 HG2 GLU A 12 10.940 10.934 -9.609 1.00 0.00 H new ATOM 0 HG3 GLU A 12 12.450 11.791 -9.842 1.00 0.00 H new ATOM 197 N ASP A 13 11.271 10.226 -14.523 1.00 0.00 N ATOM 198 CA ASP A 13 11.565 9.732 -15.863 1.00 0.00 C ATOM 199 C ASP A 13 12.943 9.084 -15.921 1.00 0.00 C ATOM 200 O ASP A 13 13.902 9.684 -16.406 1.00 0.00 O ATOM 201 CB ASP A 13 11.487 10.869 -16.884 1.00 0.00 C ATOM 202 CG ASP A 13 11.621 10.386 -18.322 1.00 0.00 C ATOM 203 OD1 ASP A 13 11.732 9.199 -18.521 1.00 0.00 O ATOM 204 OD2 ASP A 13 11.612 11.207 -19.207 1.00 0.00 O ATOM 0 H ASP A 13 11.333 11.239 -14.425 1.00 0.00 H new ATOM 0 HA ASP A 13 10.817 8.978 -16.108 1.00 0.00 H new ATOM 0 HB2 ASP A 13 10.536 11.390 -16.768 1.00 0.00 H new ATOM 0 HB3 ASP A 13 12.274 11.593 -16.675 1.00 0.00 H new ATOM 209 N SER A 14 13.035 7.856 -15.422 1.00 0.00 N ATOM 210 CA SER A 14 14.260 7.074 -15.533 1.00 0.00 C ATOM 211 C SER A 14 13.976 5.583 -15.403 1.00 0.00 C ATOM 212 O SER A 14 13.056 5.176 -14.694 1.00 0.00 O ATOM 213 CB SER A 14 15.252 7.503 -14.469 1.00 0.00 C ATOM 214 OG SER A 14 14.814 7.126 -13.193 1.00 0.00 O ATOM 0 H SER A 14 12.275 7.381 -14.936 1.00 0.00 H new ATOM 0 HA SER A 14 14.686 7.256 -16.520 1.00 0.00 H new ATOM 0 HB2 SER A 14 16.224 7.054 -14.671 1.00 0.00 H new ATOM 0 HB3 SER A 14 15.386 8.584 -14.507 1.00 0.00 H new ATOM 0 HG SER A 14 15.471 7.412 -12.524 1.00 0.00 H new ATOM 220 N GLN A 15 14.771 4.772 -16.092 1.00 0.00 N ATOM 221 CA GLN A 15 14.630 3.322 -16.027 1.00 0.00 C ATOM 222 C GLN A 15 14.960 2.799 -14.635 1.00 0.00 C ATOM 223 O GLN A 15 14.368 1.825 -14.170 1.00 0.00 O ATOM 224 CB GLN A 15 15.529 2.648 -17.066 1.00 0.00 C ATOM 225 CG GLN A 15 15.344 1.143 -17.167 1.00 0.00 C ATOM 226 CD GLN A 15 13.954 0.762 -17.637 1.00 0.00 C ATOM 227 OE1 GLN A 15 13.450 1.296 -18.629 1.00 0.00 O ATOM 228 NE2 GLN A 15 13.324 -0.167 -16.926 1.00 0.00 N ATOM 0 H GLN A 15 15.521 5.095 -16.703 1.00 0.00 H new ATOM 0 HA GLN A 15 13.590 3.079 -16.247 1.00 0.00 H new ATOM 0 HB2 GLN A 15 15.334 3.093 -18.042 1.00 0.00 H new ATOM 0 HB3 GLN A 15 16.570 2.859 -16.821 1.00 0.00 H new ATOM 0 HG2 GLN A 15 16.083 0.734 -17.857 1.00 0.00 H new ATOM 0 HG3 GLN A 15 15.532 0.690 -16.193 1.00 0.00 H new ATOM 0 HE21 GLN A 15 13.778 -0.582 -16.113 1.00 0.00 H new ATOM 0 HE22 GLN A 15 12.386 -0.465 -17.194 1.00 0.00 H new ATOM 237 N GLU A 16 15.910 3.452 -13.973 1.00 0.00 N ATOM 238 CA GLU A 16 16.300 3.073 -12.620 1.00 0.00 C ATOM 239 C GLU A 16 15.119 3.162 -11.662 1.00 0.00 C ATOM 240 O GLU A 16 14.811 2.206 -10.950 1.00 0.00 O ATOM 241 CB GLU A 16 17.440 3.966 -12.124 1.00 0.00 C ATOM 242 CG GLU A 16 17.935 3.633 -10.724 1.00 0.00 C ATOM 243 CD GLU A 16 19.062 4.520 -10.275 1.00 0.00 C ATOM 244 OE1 GLU A 16 19.454 5.378 -11.030 1.00 0.00 O ATOM 245 OE2 GLU A 16 19.533 4.340 -9.177 1.00 0.00 O ATOM 0 H GLU A 16 16.424 4.247 -14.352 1.00 0.00 H new ATOM 0 HA GLU A 16 16.642 2.038 -12.649 1.00 0.00 H new ATOM 0 HB2 GLU A 16 18.275 3.888 -12.820 1.00 0.00 H new ATOM 0 HB3 GLU A 16 17.106 5.004 -12.141 1.00 0.00 H new ATOM 0 HG2 GLU A 16 17.107 3.722 -10.021 1.00 0.00 H new ATOM 0 HG3 GLU A 16 18.265 2.594 -10.698 1.00 0.00 H new ATOM 252 N SER A 17 14.460 4.316 -11.648 1.00 0.00 N ATOM 253 CA SER A 17 13.361 4.560 -10.721 1.00 0.00 C ATOM 254 C SER A 17 12.164 3.674 -11.041 1.00 0.00 C ATOM 255 O SER A 17 11.424 3.267 -10.145 1.00 0.00 O ATOM 256 CB SER A 17 12.950 6.019 -10.771 1.00 0.00 C ATOM 257 OG SER A 17 12.425 6.350 -12.028 1.00 0.00 O ATOM 0 H SER A 17 14.668 5.098 -12.269 1.00 0.00 H new ATOM 0 HA SER A 17 13.708 4.317 -9.717 1.00 0.00 H new ATOM 0 HB2 SER A 17 12.207 6.218 -9.999 1.00 0.00 H new ATOM 0 HB3 SER A 17 13.811 6.651 -10.555 1.00 0.00 H new ATOM 0 HG SER A 17 13.147 6.663 -12.612 1.00 0.00 H new ATOM 263 N ILE A 18 11.978 3.379 -12.323 1.00 0.00 N ATOM 264 CA ILE A 18 10.916 2.479 -12.756 1.00 0.00 C ATOM 265 C ILE A 18 11.184 1.051 -12.298 1.00 0.00 C ATOM 266 O ILE A 18 10.308 0.395 -11.733 1.00 0.00 O ATOM 267 CB ILE A 18 10.763 2.507 -14.288 1.00 0.00 C ATOM 268 CG1 ILE A 18 10.207 3.858 -14.744 1.00 0.00 C ATOM 269 CG2 ILE A 18 9.862 1.373 -14.753 1.00 0.00 C ATOM 270 CD1 ILE A 18 10.287 4.079 -16.237 1.00 0.00 C ATOM 0 H ILE A 18 12.550 3.751 -13.081 1.00 0.00 H new ATOM 0 HA ILE A 18 9.989 2.826 -12.299 1.00 0.00 H new ATOM 0 HB ILE A 18 11.747 2.370 -14.737 1.00 0.00 H new ATOM 0 HG12 ILE A 18 9.166 3.937 -14.430 1.00 0.00 H new ATOM 0 HG13 ILE A 18 10.753 4.654 -14.239 1.00 0.00 H new ATOM 0 HG21 ILE A 18 9.764 1.407 -15.838 1.00 0.00 H new ATOM 0 HG22 ILE A 18 10.297 0.418 -14.458 1.00 0.00 H new ATOM 0 HG23 ILE A 18 8.878 1.480 -14.297 1.00 0.00 H new ATOM 0 HD11 ILE A 18 9.874 5.057 -16.483 1.00 0.00 H new ATOM 0 HD12 ILE A 18 11.328 4.034 -16.556 1.00 0.00 H new ATOM 0 HD13 ILE A 18 9.716 3.305 -16.750 1.00 0.00 H new ATOM 282 N SER A 19 12.399 0.574 -12.545 1.00 0.00 N ATOM 283 CA SER A 19 12.774 -0.790 -12.190 1.00 0.00 C ATOM 284 C SER A 19 12.799 -0.978 -10.678 1.00 0.00 C ATOM 285 O SER A 19 12.543 -2.072 -10.175 1.00 0.00 O ATOM 286 CB SER A 19 14.132 -1.127 -12.773 1.00 0.00 C ATOM 287 OG SER A 19 15.145 -0.390 -12.145 1.00 0.00 O ATOM 0 H SER A 19 13.142 1.112 -12.990 1.00 0.00 H new ATOM 0 HA SER A 19 12.025 -1.464 -12.606 1.00 0.00 H new ATOM 0 HB2 SER A 19 14.327 -2.193 -12.656 1.00 0.00 H new ATOM 0 HB3 SER A 19 14.135 -0.917 -13.843 1.00 0.00 H new ATOM 0 HG SER A 19 14.783 0.467 -11.836 1.00 0.00 H new ATOM 293 N SER A 20 13.109 0.094 -9.958 1.00 0.00 N ATOM 294 CA SER A 20 13.102 0.067 -8.501 1.00 0.00 C ATOM 295 C SER A 20 11.692 -0.130 -7.959 1.00 0.00 C ATOM 296 O SER A 20 11.445 -1.029 -7.156 1.00 0.00 O ATOM 297 CB SER A 20 13.690 1.352 -7.952 1.00 0.00 C ATOM 298 OG SER A 20 13.690 1.346 -6.551 1.00 0.00 O ATOM 0 H SER A 20 13.369 0.994 -10.361 1.00 0.00 H new ATOM 0 HA SER A 20 13.712 -0.777 -8.178 1.00 0.00 H new ATOM 0 HB2 SER A 20 14.709 1.476 -8.319 1.00 0.00 H new ATOM 0 HB3 SER A 20 13.115 2.204 -8.316 1.00 0.00 H new ATOM 0 HG SER A 20 14.075 2.184 -6.220 1.00 0.00 H new ATOM 304 N ALA A 21 10.770 0.717 -8.404 1.00 0.00 N ATOM 305 CA ALA A 21 9.382 0.637 -7.966 1.00 0.00 C ATOM 306 C ALA A 21 8.766 -0.707 -8.331 1.00 0.00 C ATOM 307 O ALA A 21 8.100 -1.339 -7.510 1.00 0.00 O ATOM 308 CB ALA A 21 8.569 1.773 -8.571 1.00 0.00 C ATOM 0 H ALA A 21 10.960 1.467 -9.068 1.00 0.00 H new ATOM 0 HA ALA A 21 9.366 0.731 -6.880 1.00 0.00 H new ATOM 0 HB1 ALA A 21 7.535 1.700 -8.235 1.00 0.00 H new ATOM 0 HB2 ALA A 21 8.987 2.728 -8.254 1.00 0.00 H new ATOM 0 HB3 ALA A 21 8.602 1.705 -9.658 1.00 0.00 H new ATOM 314 N SER A 22 8.991 -1.140 -9.567 1.00 0.00 N ATOM 315 CA SER A 22 8.410 -2.382 -10.061 1.00 0.00 C ATOM 316 C SER A 22 8.920 -3.581 -9.272 1.00 0.00 C ATOM 317 O SER A 22 8.188 -4.545 -9.046 1.00 0.00 O ATOM 318 CB SER A 22 8.732 -2.560 -11.532 1.00 0.00 C ATOM 319 OG SER A 22 10.110 -2.724 -11.728 1.00 0.00 O ATOM 0 H SER A 22 9.572 -0.648 -10.245 1.00 0.00 H new ATOM 0 HA SER A 22 7.329 -2.322 -9.932 1.00 0.00 H new ATOM 0 HB2 SER A 22 8.200 -3.428 -11.922 1.00 0.00 H new ATOM 0 HB3 SER A 22 8.382 -1.693 -12.092 1.00 0.00 H new ATOM 0 HG SER A 22 10.325 -2.586 -12.674 1.00 0.00 H new ATOM 325 N LYS A 23 10.180 -3.516 -8.855 1.00 0.00 N ATOM 326 CA LYS A 23 10.761 -4.550 -8.007 1.00 0.00 C ATOM 327 C LYS A 23 10.001 -4.677 -6.693 1.00 0.00 C ATOM 328 O LYS A 23 9.660 -5.780 -6.266 1.00 0.00 O ATOM 329 CB LYS A 23 12.237 -4.254 -7.735 1.00 0.00 C ATOM 330 CG LYS A 23 12.936 -5.288 -6.863 1.00 0.00 C ATOM 331 CD LYS A 23 14.408 -4.952 -6.679 1.00 0.00 C ATOM 332 CE LYS A 23 15.099 -5.962 -5.776 1.00 0.00 C ATOM 333 NZ LYS A 23 16.543 -5.651 -5.595 1.00 0.00 N ATOM 0 H LYS A 23 10.819 -2.757 -9.091 1.00 0.00 H new ATOM 0 HA LYS A 23 10.683 -5.499 -8.538 1.00 0.00 H new ATOM 0 HB2 LYS A 23 12.763 -4.185 -8.687 1.00 0.00 H new ATOM 0 HB3 LYS A 23 12.317 -3.278 -7.255 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.447 -5.336 -5.890 1.00 0.00 H new ATOM 0 HG3 LYS A 23 12.840 -6.274 -7.317 1.00 0.00 H new ATOM 0 HD2 LYS A 23 14.902 -4.932 -7.650 1.00 0.00 H new ATOM 0 HD3 LYS A 23 14.504 -3.954 -6.252 1.00 0.00 H new ATOM 0 HE2 LYS A 23 14.606 -5.976 -4.804 1.00 0.00 H new ATOM 0 HE3 LYS A 23 14.994 -6.960 -6.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 16.976 -6.363 -4.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 17.019 -5.663 -6.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 16.644 -4.709 -5.166 1.00 0.00 H new ATOM 347 N TRP A 24 9.738 -3.541 -6.056 1.00 0.00 N ATOM 348 CA TRP A 24 9.063 -3.526 -4.764 1.00 0.00 C ATOM 349 C TRP A 24 7.676 -4.150 -4.860 1.00 0.00 C ATOM 350 O TRP A 24 7.245 -4.870 -3.959 1.00 0.00 O ATOM 351 CB TRP A 24 8.946 -2.094 -4.239 1.00 0.00 C ATOM 352 CG TRP A 24 10.244 -1.531 -3.742 1.00 0.00 C ATOM 353 CD1 TRP A 24 10.878 -0.416 -4.201 1.00 0.00 C ATOM 354 CD2 TRP A 24 11.076 -2.058 -2.681 1.00 0.00 C ATOM 355 NE1 TRP A 24 12.042 -0.213 -3.503 1.00 0.00 N ATOM 356 CE2 TRP A 24 12.179 -1.207 -2.568 1.00 0.00 C ATOM 357 CE3 TRP A 24 10.974 -3.165 -1.830 1.00 0.00 C ATOM 358 CZ2 TRP A 24 13.182 -1.427 -1.637 1.00 0.00 C ATOM 359 CZ3 TRP A 24 11.980 -3.385 -0.896 1.00 0.00 C ATOM 360 CH2 TRP A 24 13.055 -2.537 -0.802 1.00 0.00 C ATOM 0 H TRP A 24 9.982 -2.618 -6.414 1.00 0.00 H new ATOM 0 HA TRP A 24 9.662 -4.117 -4.071 1.00 0.00 H new ATOM 0 HB2 TRP A 24 8.562 -1.454 -5.034 1.00 0.00 H new ATOM 0 HB3 TRP A 24 8.216 -2.071 -3.430 1.00 0.00 H new ATOM 0 HD1 TRP A 24 10.517 0.216 -4.999 1.00 0.00 H new ATOM 0 HE1 TRP A 24 12.699 0.553 -3.655 1.00 0.00 H new ATOM 0 HE3 TRP A 24 10.130 -3.835 -1.898 1.00 0.00 H new ATOM 0 HZ2 TRP A 24 14.031 -0.763 -1.561 1.00 0.00 H new ATOM 0 HZ3 TRP A 24 11.915 -4.236 -0.234 1.00 0.00 H new ATOM 0 HH2 TRP A 24 13.820 -2.734 -0.065 1.00 0.00 H new ATOM 371 N LEU A 25 6.981 -3.869 -5.957 1.00 0.00 N ATOM 372 CA LEU A 25 5.638 -4.394 -6.169 1.00 0.00 C ATOM 373 C LEU A 25 5.667 -5.896 -6.421 1.00 0.00 C ATOM 374 O LEU A 25 4.833 -6.639 -5.903 1.00 0.00 O ATOM 375 CB LEU A 25 4.971 -3.684 -7.353 1.00 0.00 C ATOM 376 CG LEU A 25 3.543 -4.137 -7.683 1.00 0.00 C ATOM 377 CD1 LEU A 25 2.679 -4.043 -6.434 1.00 0.00 C ATOM 378 CD2 LEU A 25 2.982 -3.274 -8.803 1.00 0.00 C ATOM 0 H LEU A 25 7.327 -3.279 -6.714 1.00 0.00 H new ATOM 0 HA LEU A 25 5.060 -4.208 -5.264 1.00 0.00 H new ATOM 0 HB2 LEU A 25 4.954 -2.614 -7.148 1.00 0.00 H new ATOM 0 HB3 LEU A 25 5.592 -3.830 -8.237 1.00 0.00 H new ATOM 0 HG LEU A 25 3.549 -5.174 -8.019 1.00 0.00 H new ATOM 0 HD11 LEU A 25 1.664 -4.365 -6.668 1.00 0.00 H new ATOM 0 HD12 LEU A 25 3.093 -4.685 -5.656 1.00 0.00 H new ATOM 0 HD13 LEU A 25 2.660 -3.012 -6.081 1.00 0.00 H new ATOM 0 HD21 LEU A 25 1.967 -3.596 -9.037 1.00 0.00 H new ATOM 0 HD22 LEU A 25 2.968 -2.231 -8.486 1.00 0.00 H new ATOM 0 HD23 LEU A 25 3.609 -3.375 -9.689 1.00 0.00 H new ATOM 390 N LEU A 26 6.633 -6.339 -7.219 1.00 0.00 N ATOM 391 CA LEU A 26 6.833 -7.762 -7.464 1.00 0.00 C ATOM 392 C LEU A 26 7.145 -8.505 -6.172 1.00 0.00 C ATOM 393 O LEU A 26 6.748 -9.657 -5.995 1.00 0.00 O ATOM 394 CB LEU A 26 7.972 -7.972 -8.470 1.00 0.00 C ATOM 395 CG LEU A 26 7.678 -7.528 -9.909 1.00 0.00 C ATOM 396 CD1 LEU A 26 8.959 -7.588 -10.730 1.00 0.00 C ATOM 397 CD2 LEU A 26 6.603 -8.424 -10.507 1.00 0.00 C ATOM 0 H LEU A 26 7.291 -5.731 -7.708 1.00 0.00 H new ATOM 0 HA LEU A 26 5.907 -8.163 -7.876 1.00 0.00 H new ATOM 0 HB2 LEU A 26 8.850 -7.432 -8.115 1.00 0.00 H new ATOM 0 HB3 LEU A 26 8.231 -9.031 -8.482 1.00 0.00 H new ATOM 0 HG LEU A 26 7.313 -6.501 -9.915 1.00 0.00 H new ATOM 0 HD11 LEU A 26 8.751 -7.273 -11.752 1.00 0.00 H new ATOM 0 HD12 LEU A 26 9.704 -6.925 -10.290 1.00 0.00 H new ATOM 0 HD13 LEU A 26 9.340 -8.609 -10.736 1.00 0.00 H new ATOM 0 HD21 LEU A 26 6.394 -8.109 -11.529 1.00 0.00 H new ATOM 0 HD22 LEU A 26 6.950 -9.457 -10.510 1.00 0.00 H new ATOM 0 HD23 LEU A 26 5.694 -8.349 -9.911 1.00 0.00 H new ATOM 409 N LEU A 27 7.860 -7.840 -5.270 1.00 0.00 N ATOM 410 CA LEU A 27 8.129 -8.391 -3.947 1.00 0.00 C ATOM 411 C LEU A 27 6.874 -8.385 -3.083 1.00 0.00 C ATOM 412 O LEU A 27 6.656 -9.295 -2.283 1.00 0.00 O ATOM 413 CB LEU A 27 9.238 -7.589 -3.255 1.00 0.00 C ATOM 414 CG LEU A 27 10.635 -7.713 -3.876 1.00 0.00 C ATOM 415 CD1 LEU A 27 11.572 -6.705 -3.224 1.00 0.00 C ATOM 416 CD2 LEU A 27 11.148 -9.134 -3.692 1.00 0.00 C ATOM 0 H LEU A 27 8.264 -6.917 -5.432 1.00 0.00 H new ATOM 0 HA LEU A 27 8.454 -9.424 -4.074 1.00 0.00 H new ATOM 0 HB2 LEU A 27 8.953 -6.537 -3.254 1.00 0.00 H new ATOM 0 HB3 LEU A 27 9.294 -7.905 -2.213 1.00 0.00 H new ATOM 0 HG LEU A 27 10.588 -7.499 -4.944 1.00 0.00 H new ATOM 0 HD11 LEU A 27 12.565 -6.793 -3.665 1.00 0.00 H new ATOM 0 HD12 LEU A 27 11.191 -5.697 -3.386 1.00 0.00 H new ATOM 0 HD13 LEU A 27 11.632 -6.903 -2.154 1.00 0.00 H new ATOM 0 HD21 LEU A 27 12.141 -9.222 -4.133 1.00 0.00 H new ATOM 0 HD22 LEU A 27 11.202 -9.367 -2.628 1.00 0.00 H new ATOM 0 HD23 LEU A 27 10.470 -9.832 -4.182 1.00 0.00 H new ATOM 428 N GLN A 28 6.052 -7.355 -3.248 1.00 0.00 N ATOM 429 CA GLN A 28 4.819 -7.227 -2.480 1.00 0.00 C ATOM 430 C GLN A 28 3.606 -7.608 -3.319 1.00 0.00 C ATOM 431 O GLN A 28 2.618 -6.875 -3.367 1.00 0.00 O ATOM 432 CB GLN A 28 4.662 -5.799 -1.952 1.00 0.00 C ATOM 433 CG GLN A 28 5.782 -5.350 -1.028 1.00 0.00 C ATOM 434 CD GLN A 28 5.877 -6.204 0.222 1.00 0.00 C ATOM 435 OE1 GLN A 28 4.925 -6.896 0.593 1.00 0.00 O ATOM 436 NE2 GLN A 28 7.030 -6.162 0.880 1.00 0.00 N ATOM 0 H GLN A 28 6.217 -6.595 -3.908 1.00 0.00 H new ATOM 0 HA GLN A 28 4.881 -7.913 -1.635 1.00 0.00 H new ATOM 0 HB2 GLN A 28 4.608 -5.114 -2.799 1.00 0.00 H new ATOM 0 HB3 GLN A 28 3.714 -5.723 -1.419 1.00 0.00 H new ATOM 0 HG2 GLN A 28 6.730 -5.389 -1.565 1.00 0.00 H new ATOM 0 HG3 GLN A 28 5.620 -4.310 -0.743 1.00 0.00 H new ATOM 0 HE21 GLN A 28 7.791 -5.576 0.538 1.00 0.00 H new ATOM 0 HE22 GLN A 28 7.154 -6.716 1.727 1.00 0.00 H new ATOM 445 N TYR A 29 3.687 -8.758 -3.979 1.00 0.00 N ATOM 446 CA TYR A 29 2.609 -9.222 -4.844 1.00 0.00 C ATOM 447 C TYR A 29 1.315 -9.407 -4.062 1.00 0.00 C ATOM 448 O TYR A 29 0.223 -9.345 -4.626 1.00 0.00 O ATOM 449 CB TYR A 29 3.002 -10.530 -5.535 1.00 0.00 C ATOM 450 CG TYR A 29 3.043 -11.723 -4.606 1.00 0.00 C ATOM 451 CD1 TYR A 29 1.921 -12.526 -4.458 1.00 0.00 C ATOM 452 CD2 TYR A 29 4.202 -12.014 -3.902 1.00 0.00 C ATOM 453 CE1 TYR A 29 1.959 -13.615 -3.610 1.00 0.00 C ATOM 454 CE2 TYR A 29 4.239 -13.103 -3.053 1.00 0.00 C ATOM 455 CZ TYR A 29 3.123 -13.902 -2.906 1.00 0.00 C ATOM 456 OH TYR A 29 3.161 -14.987 -2.061 1.00 0.00 O ATOM 0 H TYR A 29 4.489 -9.387 -3.931 1.00 0.00 H new ATOM 0 HA TYR A 29 2.439 -8.459 -5.604 1.00 0.00 H new ATOM 0 HB2 TYR A 29 2.295 -10.732 -6.339 1.00 0.00 H new ATOM 0 HB3 TYR A 29 3.982 -10.406 -5.996 1.00 0.00 H new ATOM 0 HD1 TYR A 29 1.018 -12.299 -5.006 1.00 0.00 H new ATOM 0 HD2 TYR A 29 5.075 -11.389 -4.018 1.00 0.00 H new ATOM 0 HE1 TYR A 29 1.087 -14.242 -3.494 1.00 0.00 H new ATOM 0 HE2 TYR A 29 5.141 -13.329 -2.504 1.00 0.00 H new ATOM 0 HH TYR A 29 4.047 -15.048 -1.647 1.00 0.00 H new ATOM 466 N ARG A 30 1.444 -9.633 -2.759 1.00 0.00 N ATOM 467 CA ARG A 30 0.293 -9.929 -1.914 1.00 0.00 C ATOM 468 C ARG A 30 -0.584 -8.698 -1.728 1.00 0.00 C ATOM 469 O ARG A 30 -1.759 -8.809 -1.378 1.00 0.00 O ATOM 470 CB ARG A 30 0.745 -10.438 -0.553 1.00 0.00 C ATOM 471 CG ARG A 30 1.429 -11.796 -0.573 1.00 0.00 C ATOM 472 CD ARG A 30 1.873 -12.206 0.784 1.00 0.00 C ATOM 473 NE ARG A 30 2.581 -13.476 0.762 1.00 0.00 N ATOM 474 CZ ARG A 30 3.134 -14.063 1.841 1.00 0.00 C ATOM 475 NH1 ARG A 30 3.053 -13.483 3.018 1.00 0.00 N ATOM 476 NH2 ARG A 30 3.758 -15.221 1.717 1.00 0.00 N ATOM 0 H ARG A 30 2.336 -9.617 -2.264 1.00 0.00 H new ATOM 0 HA ARG A 30 -0.290 -10.703 -2.413 1.00 0.00 H new ATOM 0 HB2 ARG A 30 1.429 -9.709 -0.117 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -0.123 -10.494 0.104 1.00 0.00 H new ATOM 0 HG2 ARG A 30 0.744 -12.543 -0.973 1.00 0.00 H new ATOM 0 HG3 ARG A 30 2.289 -11.761 -1.242 1.00 0.00 H new ATOM 0 HD2 ARG A 30 2.521 -11.436 1.202 1.00 0.00 H new ATOM 0 HD3 ARG A 30 1.007 -12.284 1.441 1.00 0.00 H new ATOM 0 HE ARG A 30 2.665 -13.956 -0.134 1.00 0.00 H new ATOM 0 HH11 ARG A 30 2.572 -12.589 3.114 1.00 0.00 H new ATOM 0 HH12 ARG A 30 3.472 -13.927 3.835 1.00 0.00 H new ATOM 0 HH21 ARG A 30 3.821 -15.671 0.804 1.00 0.00 H new ATOM 0 HH22 ARG A 30 4.177 -15.665 2.534 1.00 0.00 H new ATOM 490 N ASP A 31 -0.007 -7.525 -1.963 1.00 0.00 N ATOM 491 CA ASP A 31 -0.734 -6.270 -1.816 1.00 0.00 C ATOM 492 C ASP A 31 -1.210 -5.747 -3.165 1.00 0.00 C ATOM 493 O ASP A 31 -1.768 -4.653 -3.256 1.00 0.00 O ATOM 494 CB ASP A 31 0.145 -5.218 -1.135 1.00 0.00 C ATOM 495 CG ASP A 31 0.467 -5.561 0.313 1.00 0.00 C ATOM 496 OD1 ASP A 31 -0.244 -6.352 0.888 1.00 0.00 O ATOM 497 OD2 ASP A 31 1.420 -5.030 0.831 1.00 0.00 O ATOM 0 H ASP A 31 0.964 -7.417 -2.257 1.00 0.00 H new ATOM 0 HA ASP A 31 -1.607 -6.465 -1.194 1.00 0.00 H new ATOM 0 HB2 ASP A 31 1.075 -5.113 -1.693 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -0.359 -4.252 -1.171 1.00 0.00 H new ATOM 502 N ALA A 32 -0.986 -6.534 -4.211 1.00 0.00 N ATOM 503 CA ALA A 32 -1.203 -6.074 -5.578 1.00 0.00 C ATOM 504 C ALA A 32 -2.650 -5.649 -5.792 1.00 0.00 C ATOM 505 O ALA A 32 -2.921 -4.630 -6.427 1.00 0.00 O ATOM 506 CB ALA A 32 -0.819 -7.160 -6.571 1.00 0.00 C ATOM 0 H ALA A 32 -0.654 -7.496 -4.138 1.00 0.00 H new ATOM 0 HA ALA A 32 -0.567 -5.204 -5.745 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -0.987 -6.801 -7.586 1.00 0.00 H new ATOM 0 HB2 ALA A 32 0.234 -7.412 -6.445 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -1.428 -8.046 -6.394 1.00 0.00 H new ATOM 512 N PRO A 33 -3.578 -6.436 -5.258 1.00 0.00 N ATOM 513 CA PRO A 33 -4.999 -6.133 -5.374 1.00 0.00 C ATOM 514 C PRO A 33 -5.297 -4.707 -4.931 1.00 0.00 C ATOM 515 O PRO A 33 -6.144 -4.029 -5.513 1.00 0.00 O ATOM 516 CB PRO A 33 -5.648 -7.161 -4.442 1.00 0.00 C ATOM 517 CG PRO A 33 -4.743 -8.343 -4.514 1.00 0.00 C ATOM 518 CD PRO A 33 -3.358 -7.753 -4.535 1.00 0.00 C ATOM 0 HA PRO A 33 -5.371 -6.193 -6.397 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -5.727 -6.781 -3.423 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -6.658 -7.412 -4.767 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -4.881 -9.002 -3.657 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -4.935 -8.937 -5.407 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -2.964 -7.604 -3.530 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -2.651 -8.393 -5.063 1.00 0.00 H new ATOM 526 N LYS A 34 -4.594 -4.255 -3.898 1.00 0.00 N ATOM 527 CA LYS A 34 -4.799 -2.916 -3.358 1.00 0.00 C ATOM 528 C LYS A 34 -3.997 -1.880 -4.136 1.00 0.00 C ATOM 529 O LYS A 34 -4.433 -0.741 -4.304 1.00 0.00 O ATOM 530 CB LYS A 34 -4.419 -2.871 -1.877 1.00 0.00 C ATOM 531 CG LYS A 34 -5.345 -3.666 -0.966 1.00 0.00 C ATOM 532 CD LYS A 34 -4.893 -3.588 0.484 1.00 0.00 C ATOM 533 CE LYS A 34 -5.813 -4.389 1.395 1.00 0.00 C ATOM 534 NZ LYS A 34 -5.355 -4.361 2.811 1.00 0.00 N ATOM 0 H LYS A 34 -3.876 -4.797 -3.417 1.00 0.00 H new ATOM 0 HA LYS A 34 -5.857 -2.675 -3.459 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -3.404 -3.250 -1.763 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -4.410 -1.832 -1.548 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -6.362 -3.283 -1.053 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -5.368 -4.708 -1.287 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -3.874 -3.965 0.570 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -4.876 -2.547 0.806 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -6.825 -3.988 1.333 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -5.858 -5.421 1.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -6.008 -4.918 3.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -4.400 -4.767 2.875 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -5.337 -3.378 3.151 1.00 0.00 H new ATOM 548 N VAL A 35 -2.823 -2.282 -4.610 1.00 0.00 N ATOM 549 CA VAL A 35 -1.957 -1.389 -5.370 1.00 0.00 C ATOM 550 C VAL A 35 -2.617 -0.961 -6.674 1.00 0.00 C ATOM 551 O VAL A 35 -2.501 0.192 -7.091 1.00 0.00 O ATOM 552 CB VAL A 35 -0.616 -2.081 -5.681 1.00 0.00 C ATOM 553 CG1 VAL A 35 0.170 -1.282 -6.710 1.00 0.00 C ATOM 554 CG2 VAL A 35 0.188 -2.250 -4.400 1.00 0.00 C ATOM 0 H VAL A 35 -2.449 -3.222 -4.481 1.00 0.00 H new ATOM 0 HA VAL A 35 -1.779 -0.503 -4.761 1.00 0.00 H new ATOM 0 HB VAL A 35 -0.815 -3.067 -6.101 1.00 0.00 H new ATOM 0 HG11 VAL A 35 1.114 -1.785 -6.918 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -0.409 -1.204 -7.630 1.00 0.00 H new ATOM 0 HG13 VAL A 35 0.369 -0.284 -6.321 1.00 0.00 H new ATOM 0 HG21 VAL A 35 1.135 -2.740 -4.627 1.00 0.00 H new ATOM 0 HG22 VAL A 35 0.382 -1.272 -3.960 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -0.376 -2.860 -3.694 1.00 0.00 H new ATOM 564 N ALA A 36 -3.311 -1.895 -7.316 1.00 0.00 N ATOM 565 CA ALA A 36 -4.004 -1.612 -8.567 1.00 0.00 C ATOM 566 C ALA A 36 -5.000 -0.471 -8.398 1.00 0.00 C ATOM 567 O ALA A 36 -5.166 0.358 -9.293 1.00 0.00 O ATOM 568 CB ALA A 36 -4.711 -2.860 -9.076 1.00 0.00 C ATOM 0 H ALA A 36 -3.408 -2.856 -6.989 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.260 -1.305 -9.302 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -5.224 -2.632 -10.011 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -3.979 -3.649 -9.247 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -5.438 -3.194 -8.336 1.00 0.00 H new ATOM 574 N GLU A 37 -5.660 -0.434 -7.246 1.00 0.00 N ATOM 575 CA GLU A 37 -6.603 0.634 -6.938 1.00 0.00 C ATOM 576 C GLU A 37 -5.883 1.957 -6.712 1.00 0.00 C ATOM 577 O GLU A 37 -6.344 3.010 -7.153 1.00 0.00 O ATOM 578 CB GLU A 37 -7.429 0.275 -5.701 1.00 0.00 C ATOM 579 CG GLU A 37 -8.402 -0.877 -5.907 1.00 0.00 C ATOM 580 CD GLU A 37 -9.192 -1.204 -4.671 1.00 0.00 C ATOM 581 OE1 GLU A 37 -8.881 -0.674 -3.631 1.00 0.00 O ATOM 582 OE2 GLU A 37 -10.110 -1.985 -4.765 1.00 0.00 O ATOM 0 H GLU A 37 -5.559 -1.132 -6.509 1.00 0.00 H new ATOM 0 HA GLU A 37 -7.269 0.747 -7.794 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -6.750 0.020 -4.887 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -7.989 1.155 -5.385 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -9.089 -0.626 -6.715 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -7.848 -1.761 -6.223 1.00 0.00 H new ATOM 589 N MET A 38 -4.748 1.898 -6.023 1.00 0.00 N ATOM 590 CA MET A 38 -3.922 3.079 -5.803 1.00 0.00 C ATOM 591 C MET A 38 -3.246 3.526 -7.092 1.00 0.00 C ATOM 592 O MET A 38 -2.978 4.712 -7.286 1.00 0.00 O ATOM 593 CB MET A 38 -2.879 2.799 -4.723 1.00 0.00 C ATOM 594 CG MET A 38 -3.450 2.647 -3.320 1.00 0.00 C ATOM 595 SD MET A 38 -2.169 2.565 -2.053 1.00 0.00 S ATOM 596 CE MET A 38 -1.562 0.898 -2.292 1.00 0.00 C ATOM 0 H MET A 38 -4.379 1.043 -5.607 1.00 0.00 H new ATOM 0 HA MET A 38 -4.570 3.888 -5.467 1.00 0.00 H new ATOM 0 HB2 MET A 38 -2.340 1.888 -4.983 1.00 0.00 H new ATOM 0 HB3 MET A 38 -2.151 3.610 -4.720 1.00 0.00 H new ATOM 0 HG2 MET A 38 -4.112 3.487 -3.108 1.00 0.00 H new ATOM 0 HG3 MET A 38 -4.058 1.743 -3.275 1.00 0.00 H new ATOM 0 HE1 MET A 38 -1.166 0.516 -1.351 1.00 0.00 H new ATOM 0 HE2 MET A 38 -2.378 0.258 -2.628 1.00 0.00 H new ATOM 0 HE3 MET A 38 -0.772 0.903 -3.043 1.00 0.00 H new ATOM 606 N TRP A 39 -2.971 2.569 -7.973 1.00 0.00 N ATOM 607 CA TRP A 39 -2.337 2.865 -9.252 1.00 0.00 C ATOM 608 C TRP A 39 -3.263 3.670 -10.153 1.00 0.00 C ATOM 609 O TRP A 39 -2.861 4.681 -10.729 1.00 0.00 O ATOM 610 CB TRP A 39 -1.931 1.570 -9.958 1.00 0.00 C ATOM 611 CG TRP A 39 -1.266 1.793 -11.282 1.00 0.00 C ATOM 612 CD1 TRP A 39 0.041 2.114 -11.494 1.00 0.00 C ATOM 613 CD2 TRP A 39 -1.876 1.711 -12.593 1.00 0.00 C ATOM 614 NE1 TRP A 39 0.286 2.239 -12.839 1.00 0.00 N ATOM 615 CE2 TRP A 39 -0.875 1.994 -13.527 1.00 0.00 C ATOM 616 CE3 TRP A 39 -3.171 1.424 -13.042 1.00 0.00 C ATOM 617 CZ2 TRP A 39 -1.125 2.002 -14.890 1.00 0.00 C ATOM 618 CZ3 TRP A 39 -3.421 1.431 -14.409 1.00 0.00 C ATOM 619 CH2 TRP A 39 -2.424 1.712 -15.309 1.00 0.00 C ATOM 0 H TRP A 39 -3.178 1.581 -7.824 1.00 0.00 H new ATOM 0 HA TRP A 39 -1.447 3.461 -9.050 1.00 0.00 H new ATOM 0 HB2 TRP A 39 -1.256 1.010 -9.311 1.00 0.00 H new ATOM 0 HB3 TRP A 39 -2.817 0.953 -10.105 1.00 0.00 H new ATOM 0 HD1 TRP A 39 0.778 2.250 -10.716 1.00 0.00 H new ATOM 0 HE1 TRP A 39 1.185 2.476 -13.258 1.00 0.00 H new ATOM 0 HE3 TRP A 39 -3.960 1.201 -12.339 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 -0.344 2.224 -15.601 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 -4.416 1.212 -14.769 1.00 0.00 H new ATOM 0 HH2 TRP A 39 -2.650 1.709 -16.365 1.00 0.00 H new ATOM 630 N LYS A 40 -4.506 3.216 -10.273 1.00 0.00 N ATOM 631 CA LYS A 40 -5.494 3.896 -11.102 1.00 0.00 C ATOM 632 C LYS A 40 -5.864 5.253 -10.517 1.00 0.00 C ATOM 633 O LYS A 40 -6.250 6.168 -11.244 1.00 0.00 O ATOM 634 CB LYS A 40 -6.746 3.032 -11.260 1.00 0.00 C ATOM 635 CG LYS A 40 -7.583 2.899 -9.994 1.00 0.00 C ATOM 636 CD LYS A 40 -8.868 2.130 -10.259 1.00 0.00 C ATOM 637 CE LYS A 40 -9.753 2.085 -9.022 1.00 0.00 C ATOM 638 NZ LYS A 40 -11.033 1.372 -9.279 1.00 0.00 N ATOM 0 H LYS A 40 -4.853 2.379 -9.806 1.00 0.00 H new ATOM 0 HA LYS A 40 -5.050 4.059 -12.084 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -7.368 3.455 -12.049 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -6.447 2.037 -11.589 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -7.004 2.389 -9.224 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -7.823 3.890 -9.608 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -9.411 2.598 -11.080 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -8.628 1.114 -10.574 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -9.218 1.590 -8.211 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -9.964 3.102 -8.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -11.606 1.364 -8.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -11.556 1.859 -10.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -10.833 0.394 -9.571 1.00 0.00 H new ATOM 652 N GLU A 41 -5.744 5.377 -9.200 1.00 0.00 N ATOM 653 CA GLU A 41 -5.892 6.665 -8.535 1.00 0.00 C ATOM 654 C GLU A 41 -4.801 7.637 -8.967 1.00 0.00 C ATOM 655 O GLU A 41 -5.084 8.771 -9.352 1.00 0.00 O ATOM 656 CB GLU A 41 -5.858 6.489 -7.015 1.00 0.00 C ATOM 657 CG GLU A 41 -6.002 7.783 -6.228 1.00 0.00 C ATOM 658 CD GLU A 41 -5.949 7.573 -4.740 1.00 0.00 C ATOM 659 OE1 GLU A 41 -6.685 6.750 -4.249 1.00 0.00 O ATOM 660 OE2 GLU A 41 -5.173 8.235 -4.094 1.00 0.00 O ATOM 0 H GLU A 41 -5.544 4.599 -8.571 1.00 0.00 H new ATOM 0 HA GLU A 41 -6.857 7.080 -8.826 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -6.658 5.809 -6.722 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -4.918 6.012 -6.738 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -5.209 8.471 -6.521 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -6.948 8.258 -6.489 1.00 0.00 H new ATOM 667 N TYR A 42 -3.554 7.185 -8.901 1.00 0.00 N ATOM 668 CA TYR A 42 -2.427 7.973 -9.385 1.00 0.00 C ATOM 669 C TYR A 42 -2.597 8.332 -10.855 1.00 0.00 C ATOM 670 O TYR A 42 -2.413 9.484 -11.248 1.00 0.00 O ATOM 671 CB TYR A 42 -1.114 7.217 -9.172 1.00 0.00 C ATOM 672 CG TYR A 42 0.108 7.967 -9.654 1.00 0.00 C ATOM 673 CD1 TYR A 42 0.743 8.871 -8.814 1.00 0.00 C ATOM 674 CD2 TYR A 42 0.594 7.751 -10.935 1.00 0.00 C ATOM 675 CE1 TYR A 42 1.859 9.556 -9.254 1.00 0.00 C ATOM 676 CE2 TYR A 42 1.710 8.436 -11.375 1.00 0.00 C ATOM 677 CZ TYR A 42 2.341 9.336 -10.540 1.00 0.00 C ATOM 678 OH TYR A 42 3.453 10.018 -10.978 1.00 0.00 O ATOM 0 H TYR A 42 -3.298 6.276 -8.516 1.00 0.00 H new ATOM 0 HA TYR A 42 -2.396 8.900 -8.812 1.00 0.00 H new ATOM 0 HB2 TYR A 42 -0.999 6.999 -8.110 1.00 0.00 H new ATOM 0 HB3 TYR A 42 -1.169 6.260 -9.690 1.00 0.00 H new ATOM 0 HD1 TYR A 42 0.365 9.039 -7.816 1.00 0.00 H new ATOM 0 HD2 TYR A 42 0.100 7.047 -11.588 1.00 0.00 H new ATOM 0 HE1 TYR A 42 2.355 10.260 -8.602 1.00 0.00 H new ATOM 0 HE2 TYR A 42 2.089 8.267 -12.372 1.00 0.00 H new ATOM 0 HH TYR A 42 3.939 9.469 -11.628 1.00 0.00 H new ATOM 688 N MET A 43 -2.949 7.339 -11.665 1.00 0.00 N ATOM 689 CA MET A 43 -3.136 7.547 -13.096 1.00 0.00 C ATOM 690 C MET A 43 -4.255 8.543 -13.367 1.00 0.00 C ATOM 691 O MET A 43 -4.210 9.292 -14.343 1.00 0.00 O ATOM 692 CB MET A 43 -3.426 6.217 -13.788 1.00 0.00 C ATOM 693 CG MET A 43 -2.225 5.289 -13.900 1.00 0.00 C ATOM 694 SD MET A 43 -0.905 5.979 -14.917 1.00 0.00 S ATOM 695 CE MET A 43 -1.718 6.069 -16.510 1.00 0.00 C ATOM 0 H MET A 43 -3.111 6.381 -11.354 1.00 0.00 H new ATOM 0 HA MET A 43 -2.214 7.963 -13.501 1.00 0.00 H new ATOM 0 HB2 MET A 43 -4.217 5.703 -13.242 1.00 0.00 H new ATOM 0 HB3 MET A 43 -3.808 6.418 -14.789 1.00 0.00 H new ATOM 0 HG2 MET A 43 -1.838 5.080 -12.903 1.00 0.00 H new ATOM 0 HG3 MET A 43 -2.545 4.337 -14.324 1.00 0.00 H new ATOM 0 HE1 MET A 43 -1.007 6.410 -17.263 1.00 0.00 H new ATOM 0 HE2 MET A 43 -2.091 5.082 -16.784 1.00 0.00 H new ATOM 0 HE3 MET A 43 -2.551 6.769 -16.454 1.00 0.00 H new ATOM 705 N LEU A 44 -5.260 8.548 -12.497 1.00 0.00 N ATOM 706 CA LEU A 44 -6.390 9.459 -12.637 1.00 0.00 C ATOM 707 C LEU A 44 -6.343 10.560 -11.586 1.00 0.00 C ATOM 708 O LEU A 44 -7.378 11.089 -11.180 1.00 0.00 O ATOM 709 CB LEU A 44 -7.710 8.687 -12.519 1.00 0.00 C ATOM 710 CG LEU A 44 -7.914 7.558 -13.538 1.00 0.00 C ATOM 711 CD1 LEU A 44 -9.213 6.826 -13.233 1.00 0.00 C ATOM 712 CD2 LEU A 44 -7.931 8.140 -14.944 1.00 0.00 C ATOM 0 H LEU A 44 -5.315 7.931 -11.687 1.00 0.00 H new ATOM 0 HA LEU A 44 -6.327 9.921 -13.622 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -7.773 8.263 -11.517 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -8.533 9.394 -12.618 1.00 0.00 H new ATOM 0 HG LEU A 44 -7.094 6.844 -13.471 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -9.357 6.024 -13.957 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -9.166 6.404 -12.229 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -10.047 7.525 -13.294 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -8.076 7.338 -15.668 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -8.746 8.859 -15.030 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -6.983 8.641 -15.142 1.00 0.00 H new ATOM 724 N ARG A 45 -5.136 10.902 -11.148 1.00 0.00 N ATOM 725 CA ARG A 45 -4.949 11.974 -10.177 1.00 0.00 C ATOM 726 C ARG A 45 -4.728 13.312 -10.871 1.00 0.00 C ATOM 727 O ARG A 45 -3.897 13.425 -11.772 1.00 0.00 O ATOM 728 CB ARG A 45 -3.764 11.675 -9.271 1.00 0.00 C ATOM 729 CG ARG A 45 -3.545 12.680 -8.152 1.00 0.00 C ATOM 730 CD ARG A 45 -2.506 12.220 -7.195 1.00 0.00 C ATOM 731 NE ARG A 45 -2.964 11.095 -6.397 1.00 0.00 N ATOM 732 CZ ARG A 45 -2.152 10.225 -5.764 1.00 0.00 C ATOM 733 NH1 ARG A 45 -0.847 10.365 -5.846 1.00 0.00 N ATOM 734 NH2 ARG A 45 -2.668 9.232 -5.061 1.00 0.00 N ATOM 0 H ARG A 45 -4.272 10.452 -11.450 1.00 0.00 H new ATOM 0 HA ARG A 45 -5.857 12.035 -9.577 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -3.902 10.687 -8.831 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -2.862 11.629 -9.881 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -3.249 13.639 -8.577 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -4.483 12.843 -7.621 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -1.608 11.934 -7.743 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -2.229 13.043 -6.537 1.00 0.00 H new ATOM 0 HE ARG A 45 -3.970 10.954 -6.310 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -0.449 11.132 -6.389 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -0.232 9.707 -5.367 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -3.680 9.124 -4.998 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -2.054 8.573 -4.582 1.00 0.00 H new ATOM 748 N PRO A 46 -5.476 14.324 -10.446 1.00 0.00 N ATOM 749 CA PRO A 46 -5.463 15.620 -11.113 1.00 0.00 C ATOM 750 C PRO A 46 -4.179 16.382 -10.811 1.00 0.00 C ATOM 751 O PRO A 46 -3.854 17.361 -11.482 1.00 0.00 O ATOM 752 CB PRO A 46 -6.689 16.324 -10.524 1.00 0.00 C ATOM 753 CG PRO A 46 -6.874 15.683 -9.191 1.00 0.00 C ATOM 754 CD PRO A 46 -6.523 14.236 -9.420 1.00 0.00 C ATOM 0 HA PRO A 46 -5.498 15.546 -12.200 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -6.525 17.397 -10.430 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -7.567 16.190 -11.156 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -6.227 16.135 -8.439 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -7.899 15.792 -8.836 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -6.161 13.757 -8.510 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -7.382 13.659 -9.764 1.00 0.00 H new ATOM 762 N SER A 47 -3.452 15.927 -9.796 1.00 0.00 N ATOM 763 CA SER A 47 -2.175 16.532 -9.436 1.00 0.00 C ATOM 764 C SER A 47 -1.029 15.909 -10.223 1.00 0.00 C ATOM 765 O SER A 47 0.131 16.284 -10.051 1.00 0.00 O ATOM 766 CB SER A 47 -1.924 16.375 -7.949 1.00 0.00 C ATOM 767 OG SER A 47 -2.884 17.069 -7.201 1.00 0.00 O ATOM 0 H SER A 47 -3.726 15.140 -9.207 1.00 0.00 H new ATOM 0 HA SER A 47 -2.223 17.592 -9.684 1.00 0.00 H new ATOM 0 HB2 SER A 47 -1.945 15.318 -7.683 1.00 0.00 H new ATOM 0 HB3 SER A 47 -0.929 16.746 -7.704 1.00 0.00 H new ATOM 0 HG SER A 47 -2.702 16.951 -6.245 1.00 0.00 H new ATOM 773 N VAL A 48 -1.361 14.956 -11.087 1.00 0.00 N ATOM 774 CA VAL A 48 -0.361 14.285 -11.908 1.00 0.00 C ATOM 775 C VAL A 48 -0.510 14.663 -13.377 1.00 0.00 C ATOM 776 O VAL A 48 -1.619 14.692 -13.911 1.00 0.00 O ATOM 777 CB VAL A 48 -0.486 12.757 -11.760 1.00 0.00 C ATOM 778 CG1 VAL A 48 0.506 12.050 -12.672 1.00 0.00 C ATOM 779 CG2 VAL A 48 -0.264 12.358 -10.309 1.00 0.00 C ATOM 0 H VAL A 48 -2.316 14.631 -11.237 1.00 0.00 H new ATOM 0 HA VAL A 48 0.621 14.607 -11.562 1.00 0.00 H new ATOM 0 HB VAL A 48 -1.491 12.454 -12.055 1.00 0.00 H new ATOM 0 HG11 VAL A 48 0.404 10.971 -12.554 1.00 0.00 H new ATOM 0 HG12 VAL A 48 0.306 12.323 -13.708 1.00 0.00 H new ATOM 0 HG13 VAL A 48 1.520 12.349 -12.408 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -0.354 11.276 -10.211 1.00 0.00 H new ATOM 0 HG22 VAL A 48 0.732 12.669 -9.994 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -1.011 12.842 -9.680 1.00 0.00 H new ATOM 789 N ASN A 49 0.613 14.952 -14.025 1.00 0.00 N ATOM 790 CA ASN A 49 0.606 15.375 -15.420 1.00 0.00 C ATOM 791 C ASN A 49 0.701 14.179 -16.358 1.00 0.00 C ATOM 792 O ASN A 49 0.883 13.044 -15.917 1.00 0.00 O ATOM 793 CB ASN A 49 1.733 16.355 -15.687 1.00 0.00 C ATOM 794 CG ASN A 49 3.091 15.729 -15.531 1.00 0.00 C ATOM 795 OD1 ASN A 49 3.271 14.533 -15.788 1.00 0.00 O ATOM 796 ND2 ASN A 49 4.052 16.515 -15.114 1.00 0.00 N ATOM 0 H ASN A 49 1.541 14.901 -13.605 1.00 0.00 H new ATOM 0 HA ASN A 49 -0.342 15.878 -15.613 1.00 0.00 H new ATOM 0 HB2 ASN A 49 1.633 16.751 -16.697 1.00 0.00 H new ATOM 0 HB3 ASN A 49 1.645 17.199 -15.003 1.00 0.00 H new ATOM 0 HD21 ASN A 49 4.995 16.146 -14.989 1.00 0.00 H new ATOM 0 HD22 ASN A 49 3.858 17.496 -14.914 1.00 0.00 H new ATOM 803 N THR A 50 0.578 14.439 -17.655 1.00 0.00 N ATOM 804 CA THR A 50 0.445 13.374 -18.642 1.00 0.00 C ATOM 805 C THR A 50 1.752 12.608 -18.805 1.00 0.00 C ATOM 806 O THR A 50 1.750 11.423 -19.137 1.00 0.00 O ATOM 807 CB THR A 50 0.000 13.933 -20.006 1.00 0.00 C ATOM 808 OG1 THR A 50 0.960 14.893 -20.468 1.00 0.00 O ATOM 809 CG2 THR A 50 -1.362 14.600 -19.890 1.00 0.00 C ATOM 0 H THR A 50 0.568 15.380 -18.048 1.00 0.00 H new ATOM 0 HA THR A 50 -0.320 12.689 -18.276 1.00 0.00 H new ATOM 0 HB THR A 50 -0.070 13.108 -20.715 1.00 0.00 H new ATOM 0 HG1 THR A 50 0.677 15.247 -21.337 1.00 0.00 H new ATOM 0 HG21 THR A 50 -1.661 14.989 -20.863 1.00 0.00 H new ATOM 0 HG22 THR A 50 -2.097 13.870 -19.550 1.00 0.00 H new ATOM 0 HG23 THR A 50 -1.306 15.419 -19.173 1.00 0.00 H new ATOM 817 N ARG A 51 2.866 13.292 -18.569 1.00 0.00 N ATOM 818 CA ARG A 51 4.181 12.668 -18.654 1.00 0.00 C ATOM 819 C ARG A 51 4.365 11.621 -17.563 1.00 0.00 C ATOM 820 O ARG A 51 4.874 10.529 -17.818 1.00 0.00 O ATOM 821 CB ARG A 51 5.279 13.715 -18.538 1.00 0.00 C ATOM 822 CG ARG A 51 6.693 13.179 -18.697 1.00 0.00 C ATOM 823 CD ARG A 51 7.696 14.275 -18.723 1.00 0.00 C ATOM 824 NE ARG A 51 9.049 13.767 -18.884 1.00 0.00 N ATOM 825 CZ ARG A 51 10.154 14.537 -18.931 1.00 0.00 C ATOM 826 NH1 ARG A 51 10.050 15.843 -18.828 1.00 0.00 N ATOM 827 NH2 ARG A 51 11.342 13.978 -19.081 1.00 0.00 N ATOM 0 H ARG A 51 2.884 14.280 -18.317 1.00 0.00 H new ATOM 0 HA ARG A 51 4.249 12.178 -19.625 1.00 0.00 H new ATOM 0 HB2 ARG A 51 5.110 14.483 -19.293 1.00 0.00 H new ATOM 0 HB3 ARG A 51 5.197 14.200 -17.565 1.00 0.00 H new ATOM 0 HG2 ARG A 51 6.919 12.498 -17.876 1.00 0.00 H new ATOM 0 HG3 ARG A 51 6.762 12.601 -19.618 1.00 0.00 H new ATOM 0 HD2 ARG A 51 7.465 14.959 -19.540 1.00 0.00 H new ATOM 0 HD3 ARG A 51 7.631 14.849 -17.799 1.00 0.00 H new ATOM 0 HE ARG A 51 9.170 12.758 -18.967 1.00 0.00 H new ATOM 0 HH11 ARG A 51 9.133 16.274 -18.712 1.00 0.00 H new ATOM 0 HH12 ARG A 51 10.886 16.426 -18.864 1.00 0.00 H new ATOM 0 HH21 ARG A 51 11.422 12.964 -19.161 1.00 0.00 H new ATOM 0 HH22 ARG A 51 12.179 14.560 -19.117 1.00 0.00 H new ATOM 841 N ARG A 52 3.947 11.959 -16.348 1.00 0.00 N ATOM 842 CA ARG A 52 4.052 11.042 -15.219 1.00 0.00 C ATOM 843 C ARG A 52 3.050 9.902 -15.341 1.00 0.00 C ATOM 844 O ARG A 52 3.305 8.787 -14.886 1.00 0.00 O ATOM 845 CB ARG A 52 3.820 11.779 -13.908 1.00 0.00 C ATOM 846 CG ARG A 52 4.943 12.718 -13.496 1.00 0.00 C ATOM 847 CD ARG A 52 4.661 13.371 -12.192 1.00 0.00 C ATOM 848 NE ARG A 52 5.688 14.337 -11.836 1.00 0.00 N ATOM 849 CZ ARG A 52 6.860 14.027 -11.248 1.00 0.00 C ATOM 850 NH1 ARG A 52 7.138 12.776 -10.956 1.00 0.00 N ATOM 851 NH2 ARG A 52 7.729 14.981 -10.964 1.00 0.00 N ATOM 0 H ARG A 52 3.532 12.862 -16.120 1.00 0.00 H new ATOM 0 HA ARG A 52 5.059 10.626 -15.227 1.00 0.00 H new ATOM 0 HB2 ARG A 52 2.897 12.353 -13.989 1.00 0.00 H new ATOM 0 HB3 ARG A 52 3.671 11.045 -13.116 1.00 0.00 H new ATOM 0 HG2 ARG A 52 5.878 12.161 -13.430 1.00 0.00 H new ATOM 0 HG3 ARG A 52 5.080 13.480 -14.263 1.00 0.00 H new ATOM 0 HD2 ARG A 52 3.693 13.870 -12.238 1.00 0.00 H new ATOM 0 HD3 ARG A 52 4.591 12.612 -11.413 1.00 0.00 H new ATOM 0 HE ARG A 52 5.508 15.319 -12.046 1.00 0.00 H new ATOM 0 HH11 ARG A 52 6.467 12.040 -11.175 1.00 0.00 H new ATOM 0 HH12 ARG A 52 8.025 12.541 -10.511 1.00 0.00 H new ATOM 0 HH21 ARG A 52 7.512 15.952 -11.190 1.00 0.00 H new ATOM 0 HH22 ARG A 52 8.616 14.747 -10.519 1.00 0.00 H new ATOM 865 N LYS A 53 1.908 10.187 -15.958 1.00 0.00 N ATOM 866 CA LYS A 53 0.926 9.155 -16.269 1.00 0.00 C ATOM 867 C LYS A 53 1.482 8.149 -17.268 1.00 0.00 C ATOM 868 O LYS A 53 1.291 6.942 -17.120 1.00 0.00 O ATOM 869 CB LYS A 53 -0.358 9.784 -16.813 1.00 0.00 C ATOM 870 CG LYS A 53 -1.174 10.544 -15.777 1.00 0.00 C ATOM 871 CD LYS A 53 -2.366 11.242 -16.415 1.00 0.00 C ATOM 872 CE LYS A 53 -3.110 12.104 -15.406 1.00 0.00 C ATOM 873 NZ LYS A 53 -4.198 12.894 -16.044 1.00 0.00 N ATOM 0 H LYS A 53 1.640 11.126 -16.253 1.00 0.00 H new ATOM 0 HA LYS A 53 0.695 8.625 -15.345 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -0.099 10.464 -17.624 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -0.980 8.998 -17.242 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -1.523 9.854 -15.008 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -0.541 11.280 -15.281 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -2.025 11.862 -17.244 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -3.045 10.498 -16.831 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -3.532 11.469 -14.627 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -2.408 12.781 -14.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -4.680 13.467 -15.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -3.793 13.519 -16.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -4.882 12.248 -16.486 1.00 0.00 H new ATOM 887 N LEU A 54 2.169 8.654 -18.287 1.00 0.00 N ATOM 888 CA LEU A 54 2.844 7.797 -19.255 1.00 0.00 C ATOM 889 C LEU A 54 3.893 6.922 -18.579 1.00 0.00 C ATOM 890 O LEU A 54 4.019 5.737 -18.887 1.00 0.00 O ATOM 891 CB LEU A 54 3.506 8.648 -20.346 1.00 0.00 C ATOM 892 CG LEU A 54 4.204 7.867 -21.467 1.00 0.00 C ATOM 893 CD1 LEU A 54 3.184 7.005 -22.197 1.00 0.00 C ATOM 894 CD2 LEU A 54 4.878 8.842 -22.421 1.00 0.00 C ATOM 0 H LEU A 54 2.273 9.653 -18.464 1.00 0.00 H new ATOM 0 HA LEU A 54 2.094 7.148 -19.707 1.00 0.00 H new ATOM 0 HB2 LEU A 54 2.745 9.288 -20.793 1.00 0.00 H new ATOM 0 HB3 LEU A 54 4.238 9.304 -19.875 1.00 0.00 H new ATOM 0 HG LEU A 54 4.968 7.214 -21.046 1.00 0.00 H new ATOM 0 HD11 LEU A 54 3.680 6.450 -22.993 1.00 0.00 H new ATOM 0 HD12 LEU A 54 2.730 6.305 -21.495 1.00 0.00 H new ATOM 0 HD13 LEU A 54 2.410 7.642 -22.626 1.00 0.00 H new ATOM 0 HD21 LEU A 54 5.374 8.287 -23.218 1.00 0.00 H new ATOM 0 HD22 LEU A 54 4.129 9.505 -22.853 1.00 0.00 H new ATOM 0 HD23 LEU A 54 5.615 9.433 -21.877 1.00 0.00 H new ATOM 906 N LEU A 55 4.643 7.514 -17.655 1.00 0.00 N ATOM 907 CA LEU A 55 5.599 6.764 -16.849 1.00 0.00 C ATOM 908 C LEU A 55 4.901 5.693 -16.021 1.00 0.00 C ATOM 909 O LEU A 55 5.422 4.591 -15.849 1.00 0.00 O ATOM 910 CB LEU A 55 6.371 7.713 -15.924 1.00 0.00 C ATOM 911 CG LEU A 55 7.381 8.639 -16.613 1.00 0.00 C ATOM 912 CD1 LEU A 55 7.905 9.657 -15.609 1.00 0.00 C ATOM 913 CD2 LEU A 55 8.517 7.809 -17.193 1.00 0.00 C ATOM 0 H LEU A 55 4.607 8.512 -17.446 1.00 0.00 H new ATOM 0 HA LEU A 55 6.296 6.273 -17.528 1.00 0.00 H new ATOM 0 HB2 LEU A 55 5.652 8.328 -15.383 1.00 0.00 H new ATOM 0 HB3 LEU A 55 6.901 7.116 -15.182 1.00 0.00 H new ATOM 0 HG LEU A 55 6.897 9.177 -17.428 1.00 0.00 H new ATOM 0 HD11 LEU A 55 8.623 10.315 -16.099 1.00 0.00 H new ATOM 0 HD12 LEU A 55 7.075 10.249 -15.224 1.00 0.00 H new ATOM 0 HD13 LEU A 55 8.393 9.137 -14.785 1.00 0.00 H new ATOM 0 HD21 LEU A 55 9.235 8.467 -17.683 1.00 0.00 H new ATOM 0 HD22 LEU A 55 9.014 7.262 -16.392 1.00 0.00 H new ATOM 0 HD23 LEU A 55 8.117 7.103 -17.921 1.00 0.00 H new ATOM 925 N GLY A 56 3.720 6.023 -15.511 1.00 0.00 N ATOM 926 CA GLY A 56 2.909 5.062 -14.773 1.00 0.00 C ATOM 927 C GLY A 56 2.586 3.842 -15.627 1.00 0.00 C ATOM 928 O GLY A 56 2.605 2.711 -15.143 1.00 0.00 O ATOM 0 H GLY A 56 3.302 6.950 -15.595 1.00 0.00 H new ATOM 0 HA2 GLY A 56 3.440 4.749 -13.874 1.00 0.00 H new ATOM 0 HA3 GLY A 56 1.983 5.537 -14.448 1.00 0.00 H new ATOM 932 N LEU A 57 2.289 4.080 -16.900 1.00 0.00 N ATOM 933 CA LEU A 57 2.039 2.997 -17.843 1.00 0.00 C ATOM 934 C LEU A 57 3.284 2.142 -18.043 1.00 0.00 C ATOM 935 O LEU A 57 3.209 0.914 -18.065 1.00 0.00 O ATOM 936 CB LEU A 57 1.579 3.564 -19.192 1.00 0.00 C ATOM 937 CG LEU A 57 0.210 4.256 -19.191 1.00 0.00 C ATOM 938 CD1 LEU A 57 -0.014 4.941 -20.532 1.00 0.00 C ATOM 939 CD2 LEU A 57 -0.878 3.229 -18.912 1.00 0.00 C ATOM 0 H LEU A 57 2.216 5.014 -17.302 1.00 0.00 H new ATOM 0 HA LEU A 57 1.252 2.367 -17.428 1.00 0.00 H new ATOM 0 HB2 LEU A 57 2.326 4.278 -19.539 1.00 0.00 H new ATOM 0 HB3 LEU A 57 1.554 2.751 -19.917 1.00 0.00 H new ATOM 0 HG LEU A 57 0.176 5.014 -18.408 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -0.987 5.433 -20.531 1.00 0.00 H new ATOM 0 HD12 LEU A 57 0.767 5.683 -20.697 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.017 4.199 -21.329 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -1.851 3.721 -18.911 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -0.860 2.461 -19.685 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -0.703 2.769 -17.939 1.00 0.00 H new ATOM 951 N TYR A 58 4.430 2.799 -18.187 1.00 0.00 N ATOM 952 CA TYR A 58 5.697 2.100 -18.366 1.00 0.00 C ATOM 953 C TYR A 58 6.058 1.290 -17.128 1.00 0.00 C ATOM 954 O TYR A 58 6.597 0.188 -17.231 1.00 0.00 O ATOM 955 CB TYR A 58 6.814 3.093 -18.695 1.00 0.00 C ATOM 956 CG TYR A 58 6.656 3.766 -20.040 1.00 0.00 C ATOM 957 CD1 TYR A 58 7.274 4.984 -20.283 1.00 0.00 C ATOM 958 CD2 TYR A 58 5.894 3.165 -21.031 1.00 0.00 C ATOM 959 CE1 TYR A 58 7.130 5.598 -21.512 1.00 0.00 C ATOM 960 CE2 TYR A 58 5.750 3.779 -22.260 1.00 0.00 C ATOM 961 CZ TYR A 58 6.365 4.991 -22.502 1.00 0.00 C ATOM 962 OH TYR A 58 6.221 5.603 -23.726 1.00 0.00 O ATOM 0 H TYR A 58 4.507 3.816 -18.183 1.00 0.00 H new ATOM 0 HA TYR A 58 5.583 1.409 -19.201 1.00 0.00 H new ATOM 0 HB2 TYR A 58 6.848 3.857 -17.919 1.00 0.00 H new ATOM 0 HB3 TYR A 58 7.770 2.571 -18.671 1.00 0.00 H new ATOM 0 HD1 TYR A 58 7.868 5.452 -19.512 1.00 0.00 H new ATOM 0 HD2 TYR A 58 5.413 2.217 -20.842 1.00 0.00 H new ATOM 0 HE1 TYR A 58 7.610 6.546 -21.703 1.00 0.00 H new ATOM 0 HE2 TYR A 58 5.156 3.311 -23.031 1.00 0.00 H new ATOM 0 HH TYR A 58 5.657 5.048 -24.305 1.00 0.00 H new ATOM 972 N LEU A 59 5.758 1.842 -15.957 1.00 0.00 N ATOM 973 CA LEU A 59 5.993 1.144 -14.699 1.00 0.00 C ATOM 974 C LEU A 59 5.142 -0.116 -14.600 1.00 0.00 C ATOM 975 O LEU A 59 5.636 -1.183 -14.238 1.00 0.00 O ATOM 976 CB LEU A 59 5.686 2.070 -13.514 1.00 0.00 C ATOM 977 CG LEU A 59 5.880 1.455 -12.122 1.00 0.00 C ATOM 978 CD1 LEU A 59 7.305 0.934 -11.990 1.00 0.00 C ATOM 979 CD2 LEU A 59 5.580 2.501 -11.059 1.00 0.00 C ATOM 0 H LEU A 59 5.351 2.772 -15.853 1.00 0.00 H new ATOM 0 HA LEU A 59 7.043 0.853 -14.669 1.00 0.00 H new ATOM 0 HB2 LEU A 59 6.320 2.953 -13.593 1.00 0.00 H new ATOM 0 HB3 LEU A 59 4.654 2.410 -13.600 1.00 0.00 H new ATOM 0 HG LEU A 59 5.194 0.619 -11.985 1.00 0.00 H new ATOM 0 HD11 LEU A 59 7.443 0.497 -11.001 1.00 0.00 H new ATOM 0 HD12 LEU A 59 7.487 0.175 -12.751 1.00 0.00 H new ATOM 0 HD13 LEU A 59 8.007 1.757 -12.124 1.00 0.00 H new ATOM 0 HD21 LEU A 59 5.718 2.064 -10.070 1.00 0.00 H new ATOM 0 HD22 LEU A 59 6.257 3.347 -11.180 1.00 0.00 H new ATOM 0 HD23 LEU A 59 4.550 2.842 -11.165 1.00 0.00 H new ATOM 991 N MET A 60 3.860 0.016 -14.924 1.00 0.00 N ATOM 992 CA MET A 60 2.966 -1.134 -14.996 1.00 0.00 C ATOM 993 C MET A 60 3.479 -2.169 -15.990 1.00 0.00 C ATOM 994 O MET A 60 3.528 -3.361 -15.690 1.00 0.00 O ATOM 995 CB MET A 60 1.557 -0.684 -15.374 1.00 0.00 C ATOM 996 CG MET A 60 0.550 -1.818 -15.514 1.00 0.00 C ATOM 997 SD MET A 60 -1.039 -1.260 -16.162 1.00 0.00 S ATOM 998 CE MET A 60 -0.602 -0.890 -17.858 1.00 0.00 C ATOM 0 H MET A 60 3.417 0.909 -15.141 1.00 0.00 H new ATOM 0 HA MET A 60 2.935 -1.602 -14.012 1.00 0.00 H new ATOM 0 HB2 MET A 60 1.197 0.014 -14.618 1.00 0.00 H new ATOM 0 HB3 MET A 60 1.604 -0.138 -16.316 1.00 0.00 H new ATOM 0 HG2 MET A 60 0.959 -2.583 -16.174 1.00 0.00 H new ATOM 0 HG3 MET A 60 0.397 -2.285 -14.541 1.00 0.00 H new ATOM 0 HE1 MET A 60 -1.505 -0.862 -18.468 1.00 0.00 H new ATOM 0 HE2 MET A 60 -0.103 0.078 -17.902 1.00 0.00 H new ATOM 0 HE3 MET A 60 0.068 -1.661 -18.237 1.00 0.00 H new ATOM 1008 N ASN A 61 3.860 -1.705 -17.175 1.00 0.00 N ATOM 1009 CA ASN A 61 4.277 -2.598 -18.249 1.00 0.00 C ATOM 1010 C ASN A 61 5.350 -3.569 -17.773 1.00 0.00 C ATOM 1011 O ASN A 61 5.284 -4.766 -18.051 1.00 0.00 O ATOM 1012 CB ASN A 61 4.770 -1.802 -19.444 1.00 0.00 C ATOM 1013 CG ASN A 61 3.647 -1.183 -20.229 1.00 0.00 C ATOM 1014 OD1 ASN A 61 2.486 -1.587 -20.099 1.00 0.00 O ATOM 1015 ND2 ASN A 61 3.970 -0.211 -21.043 1.00 0.00 N ATOM 0 H ASN A 61 3.889 -0.714 -17.416 1.00 0.00 H new ATOM 0 HA ASN A 61 3.409 -3.182 -18.555 1.00 0.00 H new ATOM 0 HB2 ASN A 61 5.444 -1.017 -19.100 1.00 0.00 H new ATOM 0 HB3 ASN A 61 5.348 -2.455 -20.097 1.00 0.00 H new ATOM 0 HD21 ASN A 61 3.250 0.246 -21.603 1.00 0.00 H new ATOM 0 HD22 ASN A 61 4.942 0.090 -21.118 1.00 0.00 H new ATOM 1022 N HIS A 62 6.337 -3.046 -17.054 1.00 0.00 N ATOM 1023 CA HIS A 62 7.418 -3.868 -16.525 1.00 0.00 C ATOM 1024 C HIS A 62 6.885 -4.936 -15.578 1.00 0.00 C ATOM 1025 O HIS A 62 7.280 -6.100 -15.654 1.00 0.00 O ATOM 1026 CB HIS A 62 8.451 -3.001 -15.796 1.00 0.00 C ATOM 1027 CG HIS A 62 9.680 -3.750 -15.383 1.00 0.00 C ATOM 1028 ND1 HIS A 62 10.552 -3.276 -14.424 1.00 0.00 N ATOM 1029 CD2 HIS A 62 10.184 -4.936 -15.797 1.00 0.00 C ATOM 1030 CE1 HIS A 62 11.539 -4.141 -14.267 1.00 0.00 C ATOM 1031 NE2 HIS A 62 11.339 -5.156 -15.088 1.00 0.00 N ATOM 0 H HIS A 62 6.410 -2.055 -16.824 1.00 0.00 H new ATOM 0 HA HIS A 62 7.899 -4.361 -17.370 1.00 0.00 H new ATOM 0 HB2 HIS A 62 8.741 -2.174 -16.444 1.00 0.00 H new ATOM 0 HB3 HIS A 62 7.987 -2.565 -14.911 1.00 0.00 H new ATOM 0 HD2 HIS A 62 9.757 -5.588 -16.545 1.00 0.00 H new ATOM 0 HE1 HIS A 62 12.368 -4.036 -13.583 1.00 0.00 H new ATOM 0 HE2 HIS A 62 11.945 -5.971 -15.180 1.00 0.00 H new ATOM 1039 N VAL A 63 5.986 -4.534 -14.687 1.00 0.00 N ATOM 1040 CA VAL A 63 5.447 -5.440 -13.680 1.00 0.00 C ATOM 1041 C VAL A 63 4.633 -6.556 -14.322 1.00 0.00 C ATOM 1042 O VAL A 63 4.815 -7.731 -14.006 1.00 0.00 O ATOM 1043 CB VAL A 63 4.559 -4.668 -12.686 1.00 0.00 C ATOM 1044 CG1 VAL A 63 3.847 -5.631 -11.748 1.00 0.00 C ATOM 1045 CG2 VAL A 63 5.404 -3.675 -11.901 1.00 0.00 C ATOM 0 H VAL A 63 5.615 -3.585 -14.642 1.00 0.00 H new ATOM 0 HA VAL A 63 6.290 -5.883 -13.149 1.00 0.00 H new ATOM 0 HB VAL A 63 3.801 -4.117 -13.243 1.00 0.00 H new ATOM 0 HG11 VAL A 63 3.224 -5.068 -11.053 1.00 0.00 H new ATOM 0 HG12 VAL A 63 3.221 -6.309 -12.329 1.00 0.00 H new ATOM 0 HG13 VAL A 63 4.585 -6.207 -11.189 1.00 0.00 H new ATOM 0 HG21 VAL A 63 4.770 -3.132 -11.200 1.00 0.00 H new ATOM 0 HG22 VAL A 63 6.178 -4.211 -11.351 1.00 0.00 H new ATOM 0 HG23 VAL A 63 5.870 -2.970 -12.589 1.00 0.00 H new ATOM 1055 N VAL A 64 3.734 -6.180 -15.225 1.00 0.00 N ATOM 1056 CA VAL A 64 2.825 -7.137 -15.845 1.00 0.00 C ATOM 1057 C VAL A 64 3.545 -7.986 -16.886 1.00 0.00 C ATOM 1058 O VAL A 64 3.124 -9.102 -17.189 1.00 0.00 O ATOM 1059 CB VAL A 64 1.648 -6.401 -16.513 1.00 0.00 C ATOM 1060 CG1 VAL A 64 0.900 -5.558 -15.492 1.00 0.00 C ATOM 1061 CG2 VAL A 64 2.159 -5.537 -17.656 1.00 0.00 C ATOM 0 H VAL A 64 3.615 -5.219 -15.544 1.00 0.00 H new ATOM 0 HA VAL A 64 2.448 -7.792 -15.060 1.00 0.00 H new ATOM 0 HB VAL A 64 0.953 -7.137 -16.917 1.00 0.00 H new ATOM 0 HG11 VAL A 64 0.072 -5.045 -15.981 1.00 0.00 H new ATOM 0 HG12 VAL A 64 0.513 -6.202 -14.702 1.00 0.00 H new ATOM 0 HG13 VAL A 64 1.579 -4.822 -15.060 1.00 0.00 H new ATOM 0 HG21 VAL A 64 1.321 -5.020 -18.124 1.00 0.00 H new ATOM 0 HG22 VAL A 64 2.868 -4.805 -17.270 1.00 0.00 H new ATOM 0 HG23 VAL A 64 2.655 -6.167 -18.395 1.00 0.00 H new ATOM 1071 N GLN A 65 4.632 -7.450 -17.430 1.00 0.00 N ATOM 1072 CA GLN A 65 5.531 -8.230 -18.272 1.00 0.00 C ATOM 1073 C GLN A 65 6.157 -9.379 -17.492 1.00 0.00 C ATOM 1074 O GLN A 65 6.196 -10.515 -17.967 1.00 0.00 O ATOM 1075 CB GLN A 65 6.629 -7.336 -18.856 1.00 0.00 C ATOM 1076 CG GLN A 65 7.617 -8.067 -19.748 1.00 0.00 C ATOM 1077 CD GLN A 65 8.667 -7.139 -20.329 1.00 0.00 C ATOM 1078 OE1 GLN A 65 8.431 -5.940 -20.499 1.00 0.00 O ATOM 1079 NE2 GLN A 65 9.836 -7.690 -20.638 1.00 0.00 N ATOM 0 H GLN A 65 4.912 -6.477 -17.303 1.00 0.00 H new ATOM 0 HA GLN A 65 4.942 -8.650 -19.088 1.00 0.00 H new ATOM 0 HB2 GLN A 65 6.163 -6.535 -19.429 1.00 0.00 H new ATOM 0 HB3 GLN A 65 7.174 -6.867 -18.037 1.00 0.00 H new ATOM 0 HG2 GLN A 65 8.108 -8.853 -19.174 1.00 0.00 H new ATOM 0 HG3 GLN A 65 7.078 -8.555 -20.560 1.00 0.00 H new ATOM 0 HE21 GLN A 65 9.988 -8.686 -20.481 1.00 0.00 H new ATOM 0 HE22 GLN A 65 10.582 -7.117 -21.033 1.00 0.00 H new ATOM 1088 N GLN A 66 6.646 -9.078 -16.294 1.00 0.00 N ATOM 1089 CA GLN A 66 7.172 -10.104 -15.401 1.00 0.00 C ATOM 1090 C GLN A 66 6.072 -11.054 -14.945 1.00 0.00 C ATOM 1091 O GLN A 66 6.307 -12.248 -14.759 1.00 0.00 O ATOM 1092 CB GLN A 66 7.846 -9.463 -14.186 1.00 0.00 C ATOM 1093 CG GLN A 66 9.160 -8.768 -14.497 1.00 0.00 C ATOM 1094 CD GLN A 66 10.216 -9.729 -15.010 1.00 0.00 C ATOM 1095 OE1 GLN A 66 10.352 -10.848 -14.508 1.00 0.00 O ATOM 1096 NE2 GLN A 66 10.971 -9.297 -16.013 1.00 0.00 N ATOM 0 H GLN A 66 6.689 -8.131 -15.918 1.00 0.00 H new ATOM 0 HA GLN A 66 7.913 -10.679 -15.956 1.00 0.00 H new ATOM 0 HB2 GLN A 66 7.161 -8.739 -13.744 1.00 0.00 H new ATOM 0 HB3 GLN A 66 8.024 -10.233 -13.435 1.00 0.00 H new ATOM 0 HG2 GLN A 66 8.989 -7.990 -15.241 1.00 0.00 H new ATOM 0 HG3 GLN A 66 9.528 -8.274 -13.598 1.00 0.00 H new ATOM 0 HE21 GLN A 66 10.823 -8.364 -16.397 1.00 0.00 H new ATOM 0 HE22 GLN A 66 11.699 -9.898 -16.399 1.00 0.00 H new ATOM 1105 N ALA A 67 4.870 -10.517 -14.766 1.00 0.00 N ATOM 1106 CA ALA A 67 3.714 -11.329 -14.405 1.00 0.00 C ATOM 1107 C ALA A 67 3.377 -12.326 -15.505 1.00 0.00 C ATOM 1108 O ALA A 67 2.957 -13.451 -15.230 1.00 0.00 O ATOM 1109 CB ALA A 67 2.514 -10.440 -14.110 1.00 0.00 C ATOM 0 H ALA A 67 4.671 -9.522 -14.865 1.00 0.00 H new ATOM 0 HA ALA A 67 3.965 -11.892 -13.506 1.00 0.00 H new ATOM 0 HB1 ALA A 67 1.659 -11.060 -13.842 1.00 0.00 H new ATOM 0 HB2 ALA A 67 2.751 -9.772 -13.282 1.00 0.00 H new ATOM 0 HB3 ALA A 67 2.272 -9.851 -14.994 1.00 0.00 H new ATOM 1115 N LYS A 68 3.562 -11.909 -16.753 1.00 0.00 N ATOM 1116 CA LYS A 68 3.357 -12.792 -17.895 1.00 0.00 C ATOM 1117 C LYS A 68 4.389 -13.912 -17.918 1.00 0.00 C ATOM 1118 O LYS A 68 4.050 -15.077 -18.126 1.00 0.00 O ATOM 1119 CB LYS A 68 3.412 -11.999 -19.202 1.00 0.00 C ATOM 1120 CG LYS A 68 3.288 -12.849 -20.459 1.00 0.00 C ATOM 1121 CD LYS A 68 1.931 -13.534 -20.531 1.00 0.00 C ATOM 1122 CE LYS A 68 1.827 -14.430 -21.757 1.00 0.00 C ATOM 1123 NZ LYS A 68 0.478 -15.046 -21.883 1.00 0.00 N ATOM 0 H LYS A 68 3.854 -10.963 -16.999 1.00 0.00 H new ATOM 0 HA LYS A 68 2.369 -13.242 -17.795 1.00 0.00 H new ATOM 0 HB2 LYS A 68 2.611 -11.259 -19.198 1.00 0.00 H new ATOM 0 HB3 LYS A 68 4.353 -11.450 -19.241 1.00 0.00 H new ATOM 0 HG2 LYS A 68 3.429 -12.222 -21.340 1.00 0.00 H new ATOM 0 HG3 LYS A 68 4.078 -13.600 -20.472 1.00 0.00 H new ATOM 0 HD2 LYS A 68 1.773 -14.127 -19.630 1.00 0.00 H new ATOM 0 HD3 LYS A 68 1.143 -12.782 -20.560 1.00 0.00 H new ATOM 0 HE2 LYS A 68 2.045 -13.847 -22.652 1.00 0.00 H new ATOM 0 HE3 LYS A 68 2.580 -15.215 -21.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 0.449 -15.648 -22.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 0.280 -15.623 -21.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -0.239 -14.297 -21.966 1.00 0.00 H new ATOM 1137 N GLY A 69 5.650 -13.552 -17.703 1.00 0.00 N ATOM 1138 CA GLY A 69 6.736 -14.524 -17.714 1.00 0.00 C ATOM 1139 C GLY A 69 6.653 -15.457 -16.513 1.00 0.00 C ATOM 1140 O GLY A 69 6.900 -16.657 -16.629 1.00 0.00 O ATOM 0 H GLY A 69 5.945 -12.593 -17.519 1.00 0.00 H new ATOM 0 HA2 GLY A 69 6.696 -15.107 -18.634 1.00 0.00 H new ATOM 0 HA3 GLY A 69 7.694 -14.003 -17.708 1.00 0.00 H new ATOM 1144 N GLN A 70 6.305 -14.898 -15.359 1.00 0.00 N ATOM 1145 CA GLN A 70 6.273 -15.661 -14.117 1.00 0.00 C ATOM 1146 C GLN A 70 4.882 -16.223 -13.851 1.00 0.00 C ATOM 1147 O GLN A 70 4.678 -16.976 -12.899 1.00 0.00 O ATOM 1148 CB GLN A 70 6.718 -14.788 -12.940 1.00 0.00 C ATOM 1149 CG GLN A 70 8.155 -14.306 -13.031 1.00 0.00 C ATOM 1150 CD GLN A 70 8.551 -13.441 -11.850 1.00 0.00 C ATOM 1151 OE1 GLN A 70 8.248 -13.762 -10.698 1.00 0.00 O ATOM 1152 NE2 GLN A 70 9.233 -12.336 -12.129 1.00 0.00 N ATOM 0 H GLN A 70 6.041 -13.918 -15.258 1.00 0.00 H new ATOM 0 HA GLN A 70 6.965 -16.496 -14.222 1.00 0.00 H new ATOM 0 HB2 GLN A 70 6.059 -13.922 -12.875 1.00 0.00 H new ATOM 0 HB3 GLN A 70 6.594 -15.353 -12.016 1.00 0.00 H new ATOM 0 HG2 GLN A 70 8.821 -15.167 -13.087 1.00 0.00 H new ATOM 0 HG3 GLN A 70 8.288 -13.740 -13.953 1.00 0.00 H new ATOM 0 HE21 GLN A 70 9.462 -12.109 -13.097 1.00 0.00 H new ATOM 0 HE22 GLN A 70 9.527 -11.715 -11.376 1.00 0.00 H new ATOM 1161 N LYS A 71 3.928 -15.852 -14.697 1.00 0.00 N ATOM 1162 CA LYS A 71 2.561 -16.345 -14.575 1.00 0.00 C ATOM 1163 C LYS A 71 1.942 -15.926 -13.248 1.00 0.00 C ATOM 1164 O LYS A 71 1.535 -16.769 -12.448 1.00 0.00 O ATOM 1165 CB LYS A 71 2.526 -17.867 -14.714 1.00 0.00 C ATOM 1166 CG LYS A 71 3.057 -18.390 -16.043 1.00 0.00 C ATOM 1167 CD LYS A 71 2.941 -19.904 -16.128 1.00 0.00 C ATOM 1168 CE LYS A 71 3.507 -20.431 -17.438 1.00 0.00 C ATOM 1169 NZ LYS A 71 3.428 -21.915 -17.521 1.00 0.00 N ATOM 0 H LYS A 71 4.076 -15.210 -15.476 1.00 0.00 H new ATOM 0 HA LYS A 71 1.974 -15.903 -15.380 1.00 0.00 H new ATOM 0 HB2 LYS A 71 3.109 -18.307 -13.905 1.00 0.00 H new ATOM 0 HB3 LYS A 71 1.498 -18.208 -14.588 1.00 0.00 H new ATOM 0 HG2 LYS A 71 2.502 -17.934 -16.863 1.00 0.00 H new ATOM 0 HG3 LYS A 71 4.100 -18.096 -16.161 1.00 0.00 H new ATOM 0 HD2 LYS A 71 3.472 -20.359 -15.291 1.00 0.00 H new ATOM 0 HD3 LYS A 71 1.895 -20.196 -16.038 1.00 0.00 H new ATOM 0 HE2 LYS A 71 2.960 -19.991 -18.272 1.00 0.00 H new ATOM 0 HE3 LYS A 71 4.546 -20.117 -17.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 3.824 -22.234 -18.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 3.971 -22.336 -16.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 2.434 -22.214 -17.453 1.00 0.00 H new ATOM 1183 N ILE A 72 1.872 -14.619 -13.019 1.00 0.00 N ATOM 1184 CA ILE A 72 1.328 -14.087 -11.776 1.00 0.00 C ATOM 1185 C ILE A 72 0.013 -13.357 -12.018 1.00 0.00 C ATOM 1186 O ILE A 72 -0.001 -12.235 -12.525 1.00 0.00 O ATOM 1187 CB ILE A 72 2.330 -13.131 -11.102 1.00 0.00 C ATOM 1188 CG1 ILE A 72 3.658 -13.846 -10.843 1.00 0.00 C ATOM 1189 CG2 ILE A 72 1.754 -12.584 -9.805 1.00 0.00 C ATOM 1190 CD1 ILE A 72 4.765 -12.928 -10.377 1.00 0.00 C ATOM 0 H ILE A 72 2.186 -13.908 -13.680 1.00 0.00 H new ATOM 0 HA ILE A 72 1.143 -14.933 -11.115 1.00 0.00 H new ATOM 0 HB ILE A 72 2.516 -12.293 -11.774 1.00 0.00 H new ATOM 0 HG12 ILE A 72 3.502 -14.621 -10.093 1.00 0.00 H new ATOM 0 HG13 ILE A 72 3.975 -14.347 -11.758 1.00 0.00 H new ATOM 0 HG21 ILE A 72 2.475 -11.910 -9.342 1.00 0.00 H new ATOM 0 HG22 ILE A 72 0.833 -12.040 -10.017 1.00 0.00 H new ATOM 0 HG23 ILE A 72 1.540 -13.409 -9.125 1.00 0.00 H new ATOM 0 HD11 ILE A 72 5.674 -13.507 -10.215 1.00 0.00 H new ATOM 0 HD12 ILE A 72 4.950 -12.167 -11.135 1.00 0.00 H new ATOM 0 HD13 ILE A 72 4.470 -12.447 -9.445 1.00 0.00 H new ATOM 1202 N ILE A 73 -1.091 -14.000 -11.652 1.00 0.00 N ATOM 1203 CA ILE A 73 -2.416 -13.437 -11.879 1.00 0.00 C ATOM 1204 C ILE A 73 -2.683 -12.261 -10.948 1.00 0.00 C ATOM 1205 O ILE A 73 -3.635 -11.506 -11.143 1.00 0.00 O ATOM 1206 CB ILE A 73 -3.508 -14.505 -11.684 1.00 0.00 C ATOM 1207 CG1 ILE A 73 -3.537 -14.979 -10.228 1.00 0.00 C ATOM 1208 CG2 ILE A 73 -3.279 -15.678 -12.624 1.00 0.00 C ATOM 1209 CD1 ILE A 73 -4.712 -15.870 -9.899 1.00 0.00 C ATOM 0 H ILE A 73 -1.094 -14.913 -11.196 1.00 0.00 H new ATOM 0 HA ILE A 73 -2.444 -13.082 -12.909 1.00 0.00 H new ATOM 0 HB ILE A 73 -4.474 -14.060 -11.921 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -2.614 -15.517 -10.013 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -3.559 -14.108 -9.573 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -4.060 -16.423 -12.473 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -3.306 -15.328 -13.656 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -2.306 -16.125 -12.418 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -4.663 -16.164 -8.851 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -5.641 -15.329 -10.081 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -4.681 -16.760 -10.528 1.00 0.00 H new ATOM 1221 N GLN A 74 -1.836 -12.112 -9.935 1.00 0.00 N ATOM 1222 CA GLN A 74 -1.992 -11.041 -8.958 1.00 0.00 C ATOM 1223 C GLN A 74 -1.745 -9.678 -9.590 1.00 0.00 C ATOM 1224 O GLN A 74 -2.099 -8.645 -9.020 1.00 0.00 O ATOM 1225 CB GLN A 74 -1.040 -11.251 -7.777 1.00 0.00 C ATOM 1226 CG GLN A 74 -1.309 -12.513 -6.977 1.00 0.00 C ATOM 1227 CD GLN A 74 -2.675 -12.501 -6.317 1.00 0.00 C ATOM 1228 OE1 GLN A 74 -3.092 -11.493 -5.740 1.00 0.00 O ATOM 1229 NE2 GLN A 74 -3.381 -13.623 -6.399 1.00 0.00 N ATOM 0 H GLN A 74 -1.034 -12.720 -9.769 1.00 0.00 H new ATOM 0 HA GLN A 74 -3.020 -11.068 -8.596 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -0.017 -11.283 -8.151 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -1.110 -10.391 -7.111 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -1.234 -13.379 -7.634 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -0.540 -12.626 -6.212 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -2.997 -14.433 -6.886 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -4.307 -13.675 -5.975 1.00 0.00 H new ATOM 1238 N PHE A 75 -1.135 -9.680 -10.770 1.00 0.00 N ATOM 1239 CA PHE A 75 -0.891 -8.447 -11.509 1.00 0.00 C ATOM 1240 C PHE A 75 -1.674 -8.425 -12.816 1.00 0.00 C ATOM 1241 O PHE A 75 -2.139 -7.372 -13.254 1.00 0.00 O ATOM 1242 CB PHE A 75 0.602 -8.285 -11.800 1.00 0.00 C ATOM 1243 CG PHE A 75 1.461 -8.272 -10.568 1.00 0.00 C ATOM 1244 CD1 PHE A 75 2.439 -9.236 -10.377 1.00 0.00 C ATOM 1245 CD2 PHE A 75 1.294 -7.295 -9.598 1.00 0.00 C ATOM 1246 CE1 PHE A 75 3.230 -9.225 -9.244 1.00 0.00 C ATOM 1247 CE2 PHE A 75 2.084 -7.281 -8.465 1.00 0.00 C ATOM 1248 CZ PHE A 75 3.053 -8.248 -8.288 1.00 0.00 C ATOM 0 H PHE A 75 -0.800 -10.523 -11.236 1.00 0.00 H new ATOM 0 HA PHE A 75 -1.229 -7.616 -10.889 1.00 0.00 H new ATOM 0 HB2 PHE A 75 0.927 -9.098 -12.449 1.00 0.00 H new ATOM 0 HB3 PHE A 75 0.757 -7.357 -12.350 1.00 0.00 H new ATOM 0 HD1 PHE A 75 2.584 -10.004 -11.122 1.00 0.00 H new ATOM 0 HD2 PHE A 75 0.537 -6.536 -9.730 1.00 0.00 H new ATOM 0 HE1 PHE A 75 3.988 -9.983 -9.107 1.00 0.00 H new ATOM 0 HE2 PHE A 75 1.944 -6.514 -7.718 1.00 0.00 H new ATOM 0 HZ PHE A 75 3.671 -8.239 -7.402 1.00 0.00 H new ATOM 1258 N GLN A 76 -1.816 -9.592 -13.435 1.00 0.00 N ATOM 1259 CA GLN A 76 -2.515 -9.703 -14.710 1.00 0.00 C ATOM 1260 C GLN A 76 -3.992 -9.363 -14.559 1.00 0.00 C ATOM 1261 O GLN A 76 -4.573 -8.687 -15.407 1.00 0.00 O ATOM 1262 CB GLN A 76 -2.359 -11.113 -15.285 1.00 0.00 C ATOM 1263 CG GLN A 76 -0.958 -11.433 -15.777 1.00 0.00 C ATOM 1264 CD GLN A 76 -0.831 -12.862 -16.271 1.00 0.00 C ATOM 1265 OE1 GLN A 76 -0.774 -13.805 -15.478 1.00 0.00 O ATOM 1266 NE2 GLN A 76 -0.784 -13.030 -17.588 1.00 0.00 N ATOM 0 H GLN A 76 -1.456 -10.475 -13.074 1.00 0.00 H new ATOM 0 HA GLN A 76 -2.067 -8.987 -15.399 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -2.638 -11.838 -14.520 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -3.059 -11.236 -16.111 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -0.693 -10.748 -16.583 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -0.245 -11.266 -14.969 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -0.834 -12.221 -18.207 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -0.698 -13.968 -17.980 1.00 0.00 H new ATOM 1275 N ASP A 77 -4.595 -9.837 -13.474 1.00 0.00 N ATOM 1276 CA ASP A 77 -6.003 -9.572 -13.202 1.00 0.00 C ATOM 1277 C ASP A 77 -6.187 -8.230 -12.506 1.00 0.00 C ATOM 1278 O ASP A 77 -7.122 -7.487 -12.805 1.00 0.00 O ATOM 1279 CB ASP A 77 -6.603 -10.686 -12.341 1.00 0.00 C ATOM 1280 CG ASP A 77 -6.684 -12.021 -13.070 1.00 0.00 C ATOM 1281 OD1 ASP A 77 -6.648 -12.018 -14.278 1.00 0.00 O ATOM 1282 OD2 ASP A 77 -6.781 -13.029 -12.413 1.00 0.00 O ATOM 0 H ASP A 77 -4.130 -10.407 -12.768 1.00 0.00 H new ATOM 0 HA ASP A 77 -6.523 -9.539 -14.159 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -6.001 -10.806 -11.440 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -7.602 -10.392 -12.020 1.00 0.00 H new ATOM 1287 N SER A 78 -5.288 -7.923 -11.576 1.00 0.00 N ATOM 1288 CA SER A 78 -5.408 -6.719 -10.763 1.00 0.00 C ATOM 1289 C SER A 78 -5.307 -5.464 -11.619 1.00 0.00 C ATOM 1290 O SER A 78 -6.116 -4.545 -11.489 1.00 0.00 O ATOM 1291 CB SER A 78 -4.331 -6.702 -9.695 1.00 0.00 C ATOM 1292 OG SER A 78 -4.530 -7.730 -8.765 1.00 0.00 O ATOM 0 H SER A 78 -4.468 -8.492 -11.367 1.00 0.00 H new ATOM 0 HA SER A 78 -6.389 -6.730 -10.288 1.00 0.00 H new ATOM 0 HB2 SER A 78 -3.351 -6.812 -10.160 1.00 0.00 H new ATOM 0 HB3 SER A 78 -4.335 -5.739 -9.184 1.00 0.00 H new ATOM 0 HG SER A 78 -3.663 -8.036 -8.425 1.00 0.00 H new ATOM 1298 N PHE A 79 -4.309 -5.430 -12.495 1.00 0.00 N ATOM 1299 CA PHE A 79 -4.115 -4.297 -13.393 1.00 0.00 C ATOM 1300 C PHE A 79 -5.052 -4.377 -14.591 1.00 0.00 C ATOM 1301 O PHE A 79 -5.439 -3.355 -15.158 1.00 0.00 O ATOM 1302 CB PHE A 79 -2.664 -4.240 -13.876 1.00 0.00 C ATOM 1303 CG PHE A 79 -1.706 -3.701 -12.853 1.00 0.00 C ATOM 1304 CD1 PHE A 79 -0.710 -4.507 -12.321 1.00 0.00 C ATOM 1305 CD2 PHE A 79 -1.797 -2.387 -12.420 1.00 0.00 C ATOM 1306 CE1 PHE A 79 0.172 -4.012 -11.380 1.00 0.00 C ATOM 1307 CE2 PHE A 79 -0.915 -1.889 -11.481 1.00 0.00 C ATOM 1308 CZ PHE A 79 0.070 -2.703 -10.960 1.00 0.00 C ATOM 0 H PHE A 79 -3.621 -6.175 -12.603 1.00 0.00 H new ATOM 0 HA PHE A 79 -4.344 -3.389 -12.835 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -2.347 -5.242 -14.164 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -2.613 -3.620 -14.771 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -0.623 -5.533 -12.646 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -2.567 -1.745 -12.822 1.00 0.00 H new ATOM 0 HE1 PHE A 79 0.942 -4.651 -10.973 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -0.996 -0.863 -11.155 1.00 0.00 H new ATOM 0 HZ PHE A 79 0.760 -2.315 -10.225 1.00 0.00 H new ATOM 1318 N GLY A 80 -5.414 -5.597 -14.972 1.00 0.00 N ATOM 1319 CA GLY A 80 -6.309 -5.812 -16.103 1.00 0.00 C ATOM 1320 C GLY A 80 -7.673 -5.181 -15.853 1.00 0.00 C ATOM 1321 O GLY A 80 -8.248 -4.551 -16.740 1.00 0.00 O ATOM 0 H GLY A 80 -5.101 -6.453 -14.514 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -5.868 -5.387 -17.005 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -6.427 -6.881 -16.279 1.00 0.00 H new ATOM 1325 N LYS A 81 -8.186 -5.355 -14.640 1.00 0.00 N ATOM 1326 CA LYS A 81 -9.515 -4.864 -14.293 1.00 0.00 C ATOM 1327 C LYS A 81 -9.572 -3.343 -14.347 1.00 0.00 C ATOM 1328 O LYS A 81 -10.601 -2.763 -14.691 1.00 0.00 O ATOM 1329 CB LYS A 81 -9.921 -5.357 -12.903 1.00 0.00 C ATOM 1330 CG LYS A 81 -10.256 -6.841 -12.835 1.00 0.00 C ATOM 1331 CD LYS A 81 -10.594 -7.267 -11.414 1.00 0.00 C ATOM 1332 CE LYS A 81 -10.916 -8.752 -11.341 1.00 0.00 C ATOM 1333 NZ LYS A 81 -11.235 -9.185 -9.954 1.00 0.00 N ATOM 0 H LYS A 81 -7.702 -5.833 -13.880 1.00 0.00 H new ATOM 0 HA LYS A 81 -10.218 -5.257 -15.027 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -9.110 -5.148 -12.205 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -10.786 -4.786 -12.567 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -11.099 -7.056 -13.492 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -9.411 -7.424 -13.200 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -9.755 -7.042 -10.756 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -11.445 -6.690 -11.053 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -11.761 -8.972 -11.993 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -10.068 -9.326 -11.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -11.448 -10.203 -9.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -10.420 -8.999 -9.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -12.060 -8.656 -9.606 1.00 0.00 H new ATOM 1347 N VAL A 82 -8.460 -2.702 -14.004 1.00 0.00 N ATOM 1348 CA VAL A 82 -8.413 -1.248 -13.904 1.00 0.00 C ATOM 1349 C VAL A 82 -7.816 -0.628 -15.160 1.00 0.00 C ATOM 1350 O VAL A 82 -7.922 0.579 -15.379 1.00 0.00 O ATOM 1351 CB VAL A 82 -7.581 -0.823 -12.679 1.00 0.00 C ATOM 1352 CG1 VAL A 82 -8.160 -1.424 -11.407 1.00 0.00 C ATOM 1353 CG2 VAL A 82 -6.132 -1.249 -12.866 1.00 0.00 C ATOM 0 H VAL A 82 -7.578 -3.167 -13.790 1.00 0.00 H new ATOM 0 HA VAL A 82 -9.437 -0.891 -13.792 1.00 0.00 H new ATOM 0 HB VAL A 82 -7.617 0.262 -12.586 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -7.560 -1.113 -10.552 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -9.185 -1.079 -11.275 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -8.150 -2.511 -11.481 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -5.549 -0.946 -11.997 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -6.083 -2.332 -12.976 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -5.726 -0.774 -13.759 1.00 0.00 H new ATOM 1363 N ALA A 83 -7.188 -1.460 -15.984 1.00 0.00 N ATOM 1364 CA ALA A 83 -6.558 -0.992 -17.213 1.00 0.00 C ATOM 1365 C ALA A 83 -7.573 -0.321 -18.130 1.00 0.00 C ATOM 1366 O ALA A 83 -7.336 0.776 -18.635 1.00 0.00 O ATOM 1367 CB ALA A 83 -5.877 -2.147 -17.932 1.00 0.00 C ATOM 0 H ALA A 83 -7.102 -2.463 -15.823 1.00 0.00 H new ATOM 0 HA ALA A 83 -5.805 -0.251 -16.945 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -5.411 -1.782 -18.847 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -5.114 -2.580 -17.285 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -6.617 -2.908 -18.180 1.00 0.00 H new ATOM 1373 N ALA A 84 -8.703 -0.987 -18.342 1.00 0.00 N ATOM 1374 CA ALA A 84 -9.735 -0.480 -19.238 1.00 0.00 C ATOM 1375 C ALA A 84 -10.223 0.893 -18.794 1.00 0.00 C ATOM 1376 O ALA A 84 -10.423 1.787 -19.617 1.00 0.00 O ATOM 1377 CB ALA A 84 -10.899 -1.456 -19.312 1.00 0.00 C ATOM 0 H ALA A 84 -8.927 -1.881 -17.905 1.00 0.00 H new ATOM 0 HA ALA A 84 -9.297 -0.378 -20.231 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -11.661 -1.063 -19.985 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -10.545 -2.417 -19.686 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -11.326 -1.589 -18.318 1.00 0.00 H new ATOM 1383 N GLU A 85 -10.413 1.055 -17.489 1.00 0.00 N ATOM 1384 CA GLU A 85 -10.906 2.311 -16.936 1.00 0.00 C ATOM 1385 C GLU A 85 -9.900 3.436 -17.144 1.00 0.00 C ATOM 1386 O GLU A 85 -10.254 4.520 -17.608 1.00 0.00 O ATOM 1387 CB GLU A 85 -11.210 2.154 -15.445 1.00 0.00 C ATOM 1388 CG GLU A 85 -11.822 3.387 -14.795 1.00 0.00 C ATOM 1389 CD GLU A 85 -13.240 3.635 -15.231 1.00 0.00 C ATOM 1390 OE1 GLU A 85 -13.880 2.705 -15.661 1.00 0.00 O ATOM 1391 OE2 GLU A 85 -13.683 4.755 -15.134 1.00 0.00 O ATOM 0 H GLU A 85 -10.233 0.331 -16.794 1.00 0.00 H new ATOM 0 HA GLU A 85 -11.824 2.570 -17.463 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -11.890 1.313 -15.312 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -10.287 1.903 -14.923 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -11.795 3.272 -13.711 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -11.215 4.259 -15.038 1.00 0.00 H new ATOM 1398 N VAL A 86 -8.645 3.173 -16.797 1.00 0.00 N ATOM 1399 CA VAL A 86 -7.599 4.185 -16.880 1.00 0.00 C ATOM 1400 C VAL A 86 -7.253 4.503 -18.329 1.00 0.00 C ATOM 1401 O VAL A 86 -7.243 5.666 -18.734 1.00 0.00 O ATOM 1402 CB VAL A 86 -6.332 3.705 -16.147 1.00 0.00 C ATOM 1403 CG1 VAL A 86 -5.172 4.655 -16.410 1.00 0.00 C ATOM 1404 CG2 VAL A 86 -6.609 3.592 -14.655 1.00 0.00 C ATOM 0 H VAL A 86 -8.327 2.266 -16.455 1.00 0.00 H new ATOM 0 HA VAL A 86 -7.976 5.090 -16.405 1.00 0.00 H new ATOM 0 HB VAL A 86 -6.055 2.721 -16.526 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -4.285 4.301 -15.885 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -4.969 4.693 -17.480 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -5.430 5.652 -16.054 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -5.709 3.252 -14.143 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -6.903 4.566 -14.265 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -7.414 2.876 -14.488 1.00 0.00 H new ATOM 1414 N LEU A 87 -6.971 3.463 -19.107 1.00 0.00 N ATOM 1415 CA LEU A 87 -6.444 3.636 -20.455 1.00 0.00 C ATOM 1416 C LEU A 87 -7.396 4.453 -21.318 1.00 0.00 C ATOM 1417 O LEU A 87 -6.966 5.279 -22.123 1.00 0.00 O ATOM 1418 CB LEU A 87 -6.197 2.269 -21.107 1.00 0.00 C ATOM 1419 CG LEU A 87 -5.059 1.439 -20.500 1.00 0.00 C ATOM 1420 CD1 LEU A 87 -5.079 0.038 -21.095 1.00 0.00 C ATOM 1421 CD2 LEU A 87 -3.729 2.128 -20.767 1.00 0.00 C ATOM 0 H LEU A 87 -7.099 2.491 -18.826 1.00 0.00 H new ATOM 0 HA LEU A 87 -5.500 4.176 -20.379 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -7.117 1.688 -21.049 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -5.985 2.424 -22.165 1.00 0.00 H new ATOM 0 HG LEU A 87 -5.192 1.356 -19.421 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -4.270 -0.552 -20.664 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -6.034 -0.438 -20.873 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -4.947 0.100 -22.175 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -2.920 1.538 -20.335 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -3.577 2.221 -21.842 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -3.736 3.120 -20.315 1.00 0.00 H new ATOM 1433 N GLY A 88 -8.692 4.216 -21.147 1.00 0.00 N ATOM 1434 CA GLY A 88 -9.711 4.966 -21.872 1.00 0.00 C ATOM 1435 C GLY A 88 -9.679 6.442 -21.498 1.00 0.00 C ATOM 1436 O GLY A 88 -9.655 7.313 -22.369 1.00 0.00 O ATOM 0 H GLY A 88 -9.062 3.509 -20.512 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -9.552 4.856 -22.945 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -10.696 4.554 -21.652 1.00 0.00 H new ATOM 1440 N ARG A 89 -9.679 6.718 -20.199 1.00 0.00 N ATOM 1441 CA ARG A 89 -9.770 8.088 -19.706 1.00 0.00 C ATOM 1442 C ARG A 89 -8.551 8.903 -20.117 1.00 0.00 C ATOM 1443 O ARG A 89 -8.675 10.053 -20.540 1.00 0.00 O ATOM 1444 CB ARG A 89 -9.900 8.104 -18.190 1.00 0.00 C ATOM 1445 CG ARG A 89 -11.252 7.654 -17.659 1.00 0.00 C ATOM 1446 CD ARG A 89 -11.293 7.673 -16.175 1.00 0.00 C ATOM 1447 NE ARG A 89 -12.569 7.203 -15.661 1.00 0.00 N ATOM 1448 CZ ARG A 89 -13.654 7.981 -15.478 1.00 0.00 C ATOM 1449 NH1 ARG A 89 -13.601 9.261 -15.771 1.00 0.00 N ATOM 1450 NH2 ARG A 89 -14.771 7.456 -15.005 1.00 0.00 N ATOM 0 H ARG A 89 -9.617 6.010 -19.467 1.00 0.00 H new ATOM 0 HA ARG A 89 -10.658 8.538 -20.150 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -9.128 7.462 -17.767 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -9.704 9.115 -17.834 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -12.033 8.305 -18.053 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -11.466 6.647 -18.016 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -10.491 7.048 -15.782 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -11.110 8.687 -15.820 1.00 0.00 H new ATOM 0 HE ARG A 89 -12.649 6.215 -15.422 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -12.739 9.665 -16.137 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -14.422 9.850 -15.633 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -14.812 6.462 -14.779 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -15.592 8.045 -14.866 1.00 0.00 H new ATOM 1464 N ILE A 90 -7.373 8.302 -19.991 1.00 0.00 N ATOM 1465 CA ILE A 90 -6.123 8.999 -20.268 1.00 0.00 C ATOM 1466 C ILE A 90 -5.893 9.143 -21.767 1.00 0.00 C ATOM 1467 O ILE A 90 -5.119 9.993 -22.207 1.00 0.00 O ATOM 1468 CB ILE A 90 -4.930 8.261 -19.634 1.00 0.00 C ATOM 1469 CG1 ILE A 90 -4.730 6.898 -20.300 1.00 0.00 C ATOM 1470 CG2 ILE A 90 -5.140 8.100 -18.136 1.00 0.00 C ATOM 1471 CD1 ILE A 90 -3.516 6.147 -19.803 1.00 0.00 C ATOM 0 H ILE A 90 -7.258 7.332 -19.698 1.00 0.00 H new ATOM 0 HA ILE A 90 -6.202 9.993 -19.828 1.00 0.00 H new ATOM 0 HB ILE A 90 -4.030 8.856 -19.792 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -5.617 6.288 -20.131 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -4.642 7.040 -21.377 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -4.288 7.576 -17.703 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -5.235 9.083 -17.674 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -6.048 7.525 -17.956 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -3.442 5.191 -20.322 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -2.619 6.736 -19.997 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -3.610 5.972 -18.731 1.00 0.00 H new ATOM 1483 N ASN A 91 -6.570 8.307 -22.547 1.00 0.00 N ATOM 1484 CA ASN A 91 -6.572 8.445 -23.998 1.00 0.00 C ATOM 1485 C ASN A 91 -7.106 9.808 -24.421 1.00 0.00 C ATOM 1486 O ASN A 91 -6.544 10.460 -25.301 1.00 0.00 O ATOM 1487 CB ASN A 91 -7.381 7.333 -24.640 1.00 0.00 C ATOM 1488 CG ASN A 91 -7.302 7.352 -26.141 1.00 0.00 C ATOM 1489 OD1 ASN A 91 -6.221 7.528 -26.716 1.00 0.00 O ATOM 1490 ND2 ASN A 91 -8.426 7.175 -26.787 1.00 0.00 N ATOM 0 H ASN A 91 -7.125 7.526 -22.198 1.00 0.00 H new ATOM 0 HA ASN A 91 -5.541 8.367 -24.343 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -7.024 6.371 -24.273 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -8.423 7.424 -24.334 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -8.434 7.179 -27.807 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -9.294 7.033 -26.271 1.00 0.00 H new ATOM 1497 N GLN A 92 -8.194 10.234 -23.788 1.00 0.00 N ATOM 1498 CA GLN A 92 -8.756 11.556 -24.037 1.00 0.00 C ATOM 1499 C GLN A 92 -7.858 12.651 -23.477 1.00 0.00 C ATOM 1500 O GLN A 92 -7.674 13.696 -24.101 1.00 0.00 O ATOM 1501 CB GLN A 92 -10.156 11.666 -23.426 1.00 0.00 C ATOM 1502 CG GLN A 92 -10.860 12.981 -23.716 1.00 0.00 C ATOM 1503 CD GLN A 92 -12.297 12.987 -23.231 1.00 0.00 C ATOM 1504 OE1 GLN A 92 -12.628 12.362 -22.219 1.00 0.00 O ATOM 1505 NE2 GLN A 92 -13.161 13.695 -23.950 1.00 0.00 N ATOM 0 H GLN A 92 -8.704 9.682 -23.098 1.00 0.00 H new ATOM 0 HA GLN A 92 -8.826 11.689 -25.117 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -10.770 10.847 -23.802 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -10.080 11.538 -22.346 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -10.315 13.795 -23.238 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -10.841 13.171 -24.789 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -12.844 14.196 -24.780 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -14.142 13.737 -23.672 1.00 0.00 H new ATOM 1514 N GLU A 93 -7.299 12.406 -22.297 1.00 0.00 N ATOM 1515 CA GLU A 93 -6.467 13.395 -21.623 1.00 0.00 C ATOM 1516 C GLU A 93 -5.154 13.609 -22.365 1.00 0.00 C ATOM 1517 O GLU A 93 -4.655 14.730 -22.452 1.00 0.00 O ATOM 1518 CB GLU A 93 -6.185 12.963 -20.182 1.00 0.00 C ATOM 1519 CG GLU A 93 -7.406 12.972 -19.272 1.00 0.00 C ATOM 1520 CD GLU A 93 -7.108 12.467 -17.888 1.00 0.00 C ATOM 1521 OE1 GLU A 93 -6.100 11.825 -17.715 1.00 0.00 O ATOM 1522 OE2 GLU A 93 -7.890 12.723 -17.003 1.00 0.00 O ATOM 0 H GLU A 93 -7.407 11.529 -21.787 1.00 0.00 H new ATOM 0 HA GLU A 93 -7.014 14.338 -21.614 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -5.763 11.958 -20.193 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -5.427 13.623 -19.759 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -7.796 13.988 -19.206 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -8.189 12.358 -19.717 1.00 0.00 H new ATOM 1529 N PHE A 94 -4.599 12.526 -22.898 1.00 0.00 N ATOM 1530 CA PHE A 94 -3.292 12.573 -23.542 1.00 0.00 C ATOM 1531 C PHE A 94 -3.353 13.344 -24.855 1.00 0.00 C ATOM 1532 O PHE A 94 -4.331 13.251 -25.596 1.00 0.00 O ATOM 1533 CB PHE A 94 -2.771 11.158 -23.800 1.00 0.00 C ATOM 1534 CG PHE A 94 -2.202 10.491 -22.580 1.00 0.00 C ATOM 1535 CD1 PHE A 94 -2.149 11.160 -21.367 1.00 0.00 C ATOM 1536 CD2 PHE A 94 -1.717 9.193 -22.644 1.00 0.00 C ATOM 1537 CE1 PHE A 94 -1.625 10.547 -20.244 1.00 0.00 C ATOM 1538 CE2 PHE A 94 -1.194 8.577 -21.523 1.00 0.00 C ATOM 1539 CZ PHE A 94 -1.148 9.256 -20.322 1.00 0.00 C ATOM 0 H PHE A 94 -5.035 11.604 -22.897 1.00 0.00 H new ATOM 0 HA PHE A 94 -2.609 13.090 -22.868 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -3.584 10.547 -24.191 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -2.003 11.199 -24.572 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -2.521 12.171 -21.298 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -1.749 8.657 -23.581 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -1.589 11.080 -19.305 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -0.822 7.565 -21.586 1.00 0.00 H new ATOM 0 HZ PHE A 94 -0.739 8.777 -19.445 1.00 0.00 H new ATOM 1549 N PRO A 95 -2.301 14.105 -25.138 1.00 0.00 N ATOM 1550 CA PRO A 95 -2.148 14.748 -26.437 1.00 0.00 C ATOM 1551 C PRO A 95 -1.835 13.727 -27.524 1.00 0.00 C ATOM 1552 O PRO A 95 -1.579 12.558 -27.235 1.00 0.00 O ATOM 1553 CB PRO A 95 -0.976 15.708 -26.210 1.00 0.00 C ATOM 1554 CG PRO A 95 -0.133 15.022 -25.191 1.00 0.00 C ATOM 1555 CD PRO A 95 -1.123 14.366 -24.266 1.00 0.00 C ATOM 0 HA PRO A 95 -3.052 15.254 -26.777 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -0.422 15.885 -27.132 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -1.320 16.679 -25.854 1.00 0.00 H new ATOM 0 HG2 PRO A 95 0.528 14.287 -25.651 1.00 0.00 H new ATOM 0 HG3 PRO A 95 0.500 15.730 -24.657 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -0.725 13.443 -23.843 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -1.380 15.015 -23.429 1.00 0.00 H new ATOM 1563 N ARG A 96 -1.857 14.175 -28.774 1.00 0.00 N ATOM 1564 CA ARG A 96 -1.669 13.283 -29.912 1.00 0.00 C ATOM 1565 C ARG A 96 -0.458 12.381 -29.710 1.00 0.00 C ATOM 1566 O ARG A 96 -0.543 11.165 -29.876 1.00 0.00 O ATOM 1567 CB ARG A 96 -1.496 14.081 -31.195 1.00 0.00 C ATOM 1568 CG ARG A 96 -1.245 13.244 -32.440 1.00 0.00 C ATOM 1569 CD ARG A 96 -0.575 14.032 -33.506 1.00 0.00 C ATOM 1570 NE ARG A 96 0.763 14.447 -33.115 1.00 0.00 N ATOM 1571 CZ ARG A 96 1.474 15.413 -33.727 1.00 0.00 C ATOM 1572 NH1 ARG A 96 0.964 16.054 -34.755 1.00 0.00 N ATOM 1573 NH2 ARG A 96 2.686 15.717 -33.294 1.00 0.00 N ATOM 0 H ARG A 96 -2.003 15.153 -29.025 1.00 0.00 H new ATOM 0 HA ARG A 96 -2.560 12.661 -29.991 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -2.390 14.684 -31.354 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -0.664 14.773 -31.066 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -0.628 12.383 -32.182 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -2.192 12.856 -32.815 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -0.518 13.436 -34.417 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -1.175 14.912 -33.738 1.00 0.00 H new ATOM 0 HE ARG A 96 1.193 13.973 -32.321 1.00 0.00 H new ATOM 0 HH11 ARG A 96 0.029 15.820 -35.089 1.00 0.00 H new ATOM 0 HH12 ARG A 96 1.503 16.786 -35.218 1.00 0.00 H new ATOM 0 HH21 ARG A 96 3.082 15.220 -32.496 1.00 0.00 H new ATOM 0 HH22 ARG A 96 3.225 16.449 -33.758 1.00 0.00 H new ATOM 1587 N ASP A 97 0.670 12.986 -29.352 1.00 0.00 N ATOM 1588 CA ASP A 97 1.933 12.263 -29.267 1.00 0.00 C ATOM 1589 C ASP A 97 1.856 11.136 -28.245 1.00 0.00 C ATOM 1590 O ASP A 97 2.346 10.033 -28.484 1.00 0.00 O ATOM 1591 CB ASP A 97 3.074 13.216 -28.900 1.00 0.00 C ATOM 1592 CG ASP A 97 3.421 14.184 -30.023 1.00 0.00 C ATOM 1593 OD1 ASP A 97 2.966 13.975 -31.123 1.00 0.00 O ATOM 1594 OD2 ASP A 97 4.138 15.122 -29.770 1.00 0.00 O ATOM 0 H ASP A 97 0.735 13.976 -29.116 1.00 0.00 H new ATOM 0 HA ASP A 97 2.130 11.828 -30.247 1.00 0.00 H new ATOM 0 HB2 ASP A 97 2.796 13.783 -28.011 1.00 0.00 H new ATOM 0 HB3 ASP A 97 3.959 12.634 -28.643 1.00 0.00 H new ATOM 1599 N LEU A 98 1.238 11.421 -27.104 1.00 0.00 N ATOM 1600 CA LEU A 98 1.150 10.453 -26.017 1.00 0.00 C ATOM 1601 C LEU A 98 0.043 9.438 -26.271 1.00 0.00 C ATOM 1602 O LEU A 98 0.079 8.323 -25.751 1.00 0.00 O ATOM 1603 CB LEU A 98 0.898 11.172 -24.686 1.00 0.00 C ATOM 1604 CG LEU A 98 2.152 11.583 -23.904 1.00 0.00 C ATOM 1605 CD1 LEU A 98 2.912 12.647 -24.684 1.00 0.00 C ATOM 1606 CD2 LEU A 98 1.748 12.097 -22.530 1.00 0.00 C ATOM 0 H LEU A 98 0.790 12.316 -26.908 1.00 0.00 H new ATOM 0 HA LEU A 98 2.099 9.920 -25.966 1.00 0.00 H new ATOM 0 HB2 LEU A 98 0.306 12.066 -24.883 1.00 0.00 H new ATOM 0 HB3 LEU A 98 0.294 10.523 -24.052 1.00 0.00 H new ATOM 0 HG LEU A 98 2.806 10.722 -23.771 1.00 0.00 H new ATOM 0 HD11 LEU A 98 3.803 12.939 -24.128 1.00 0.00 H new ATOM 0 HD12 LEU A 98 3.205 12.247 -25.655 1.00 0.00 H new ATOM 0 HD13 LEU A 98 2.273 13.518 -24.828 1.00 0.00 H new ATOM 0 HD21 LEU A 98 2.639 12.389 -21.974 1.00 0.00 H new ATOM 0 HD22 LEU A 98 1.092 12.960 -22.643 1.00 0.00 H new ATOM 0 HD23 LEU A 98 1.223 11.311 -21.987 1.00 0.00 H new ATOM 1618 N LYS A 99 -0.940 9.831 -27.074 1.00 0.00 N ATOM 1619 CA LYS A 99 -1.976 8.910 -27.524 1.00 0.00 C ATOM 1620 C LYS A 99 -1.396 7.823 -28.419 1.00 0.00 C ATOM 1621 O LYS A 99 -1.814 6.666 -28.358 1.00 0.00 O ATOM 1622 CB LYS A 99 -3.081 9.666 -28.263 1.00 0.00 C ATOM 1623 CG LYS A 99 -4.000 10.479 -27.361 1.00 0.00 C ATOM 1624 CD LYS A 99 -4.935 11.361 -28.175 1.00 0.00 C ATOM 1625 CE LYS A 99 -5.976 10.532 -28.913 1.00 0.00 C ATOM 1626 NZ LYS A 99 -6.945 11.386 -29.652 1.00 0.00 N ATOM 0 H LYS A 99 -1.041 10.783 -27.427 1.00 0.00 H new ATOM 0 HA LYS A 99 -2.403 8.433 -26.642 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -2.622 10.335 -28.991 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -3.682 8.950 -28.823 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -4.585 9.807 -26.734 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -3.402 11.099 -26.693 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -5.434 12.071 -27.516 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -4.356 11.944 -28.892 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -5.477 9.861 -29.612 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -6.514 9.907 -28.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -7.637 10.783 -30.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -7.440 12.008 -28.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -6.436 11.965 -30.350 1.00 0.00 H new ATOM 1640 N LYS A 100 -0.431 8.201 -29.250 1.00 0.00 N ATOM 1641 CA LYS A 100 0.310 7.236 -30.054 1.00 0.00 C ATOM 1642 C LYS A 100 1.130 6.301 -29.175 1.00 0.00 C ATOM 1643 O LYS A 100 1.143 5.088 -29.386 1.00 0.00 O ATOM 1644 CB LYS A 100 1.221 7.955 -31.050 1.00 0.00 C ATOM 1645 CG LYS A 100 0.483 8.662 -32.180 1.00 0.00 C ATOM 1646 CD LYS A 100 1.454 9.350 -33.128 1.00 0.00 C ATOM 1647 CE LYS A 100 0.721 10.033 -34.273 1.00 0.00 C ATOM 1648 NZ LYS A 100 1.660 10.692 -35.221 1.00 0.00 N ATOM 0 H LYS A 100 -0.143 9.170 -29.385 1.00 0.00 H new ATOM 0 HA LYS A 100 -0.414 6.637 -30.606 1.00 0.00 H new ATOM 0 HB2 LYS A 100 1.822 8.687 -30.511 1.00 0.00 H new ATOM 0 HB3 LYS A 100 1.912 7.230 -31.481 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -0.118 7.940 -32.733 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -0.205 9.398 -31.764 1.00 0.00 H new ATOM 0 HD2 LYS A 100 2.041 10.086 -32.579 1.00 0.00 H new ATOM 0 HD3 LYS A 100 2.155 8.618 -33.528 1.00 0.00 H new ATOM 0 HE2 LYS A 100 0.121 9.298 -34.809 1.00 0.00 H new ATOM 0 HE3 LYS A 100 0.031 10.775 -33.871 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 1.120 11.145 -35.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 2.215 11.412 -34.716 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 2.302 9.980 -35.625 1.00 0.00 H new ATOM 1662 N LYS A 101 1.814 6.871 -28.189 1.00 0.00 N ATOM 1663 CA LYS A 101 2.574 6.082 -27.227 1.00 0.00 C ATOM 1664 C LYS A 101 1.654 5.214 -26.378 1.00 0.00 C ATOM 1665 O LYS A 101 2.013 4.098 -26.000 1.00 0.00 O ATOM 1666 CB LYS A 101 3.412 6.994 -26.329 1.00 0.00 C ATOM 1667 CG LYS A 101 4.563 7.691 -27.041 1.00 0.00 C ATOM 1668 CD LYS A 101 5.335 8.595 -26.091 1.00 0.00 C ATOM 1669 CE LYS A 101 6.462 9.322 -26.809 1.00 0.00 C ATOM 1670 NZ LYS A 101 7.219 10.218 -25.893 1.00 0.00 N ATOM 0 H LYS A 101 1.858 7.878 -28.035 1.00 0.00 H new ATOM 0 HA LYS A 101 3.241 5.426 -27.787 1.00 0.00 H new ATOM 0 HB2 LYS A 101 2.761 7.750 -25.890 1.00 0.00 H new ATOM 0 HB3 LYS A 101 3.814 6.403 -25.506 1.00 0.00 H new ATOM 0 HG2 LYS A 101 5.236 6.946 -27.464 1.00 0.00 H new ATOM 0 HG3 LYS A 101 4.176 8.280 -27.873 1.00 0.00 H new ATOM 0 HD2 LYS A 101 4.656 9.323 -25.646 1.00 0.00 H new ATOM 0 HD3 LYS A 101 5.745 8.001 -25.274 1.00 0.00 H new ATOM 0 HE2 LYS A 101 7.143 8.592 -27.247 1.00 0.00 H new ATOM 0 HE3 LYS A 101 6.050 9.908 -27.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 7.978 10.694 -26.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 6.575 10.931 -25.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 7.634 9.656 -25.122 1.00 0.00 H new ATOM 1684 N LEU A 102 0.467 5.731 -26.082 1.00 0.00 N ATOM 1685 CA LEU A 102 -0.536 4.974 -25.344 1.00 0.00 C ATOM 1686 C LEU A 102 -0.959 3.727 -26.110 1.00 0.00 C ATOM 1687 O LEU A 102 -1.045 2.638 -25.543 1.00 0.00 O ATOM 1688 CB LEU A 102 -1.764 5.851 -25.064 1.00 0.00 C ATOM 1689 CG LEU A 102 -2.925 5.159 -24.339 1.00 0.00 C ATOM 1690 CD1 LEU A 102 -2.449 4.656 -22.983 1.00 0.00 C ATOM 1691 CD2 LEU A 102 -4.081 6.135 -24.185 1.00 0.00 C ATOM 0 H LEU A 102 0.176 6.673 -26.343 1.00 0.00 H new ATOM 0 HA LEU A 102 -0.091 4.663 -24.399 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -1.448 6.708 -24.469 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -2.133 6.241 -26.013 1.00 0.00 H new ATOM 0 HG LEU A 102 -3.272 4.305 -24.921 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -3.274 4.164 -22.467 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -1.634 3.946 -23.124 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -2.098 5.497 -22.386 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -4.906 5.643 -23.670 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -3.754 6.998 -23.605 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -4.413 6.464 -25.170 1.00 0.00 H new ATOM 1703 N SER A 103 -1.223 3.893 -27.401 1.00 0.00 N ATOM 1704 CA SER A 103 -1.630 2.780 -28.250 1.00 0.00 C ATOM 1705 C SER A 103 -0.548 1.710 -28.312 1.00 0.00 C ATOM 1706 O SER A 103 -0.841 0.525 -28.472 1.00 0.00 O ATOM 1707 CB SER A 103 -1.944 3.277 -29.648 1.00 0.00 C ATOM 1708 OG SER A 103 -0.778 3.683 -30.310 1.00 0.00 O ATOM 0 H SER A 103 -1.162 4.790 -27.883 1.00 0.00 H new ATOM 0 HA SER A 103 -2.525 2.335 -27.815 1.00 0.00 H new ATOM 0 HB2 SER A 103 -2.433 2.487 -30.217 1.00 0.00 H new ATOM 0 HB3 SER A 103 -2.644 4.111 -29.593 1.00 0.00 H new ATOM 0 HG SER A 103 -0.388 4.451 -29.843 1.00 0.00 H new ATOM 1714 N ARG A 104 0.705 2.135 -28.186 1.00 0.00 N ATOM 1715 CA ARG A 104 1.826 1.205 -28.113 1.00 0.00 C ATOM 1716 C ARG A 104 1.797 0.409 -26.815 1.00 0.00 C ATOM 1717 O ARG A 104 2.054 -0.795 -26.809 1.00 0.00 O ATOM 1718 CB ARG A 104 3.148 1.951 -28.218 1.00 0.00 C ATOM 1719 CG ARG A 104 3.447 2.533 -29.590 1.00 0.00 C ATOM 1720 CD ARG A 104 4.727 3.286 -29.600 1.00 0.00 C ATOM 1721 NE ARG A 104 5.021 3.839 -30.913 1.00 0.00 N ATOM 1722 CZ ARG A 104 6.091 4.607 -31.197 1.00 0.00 C ATOM 1723 NH1 ARG A 104 6.957 4.903 -30.254 1.00 0.00 N ATOM 1724 NH2 ARG A 104 6.269 5.063 -32.425 1.00 0.00 N ATOM 0 H ARG A 104 0.970 3.119 -28.132 1.00 0.00 H new ATOM 0 HA ARG A 104 1.733 0.514 -28.951 1.00 0.00 H new ATOM 0 HB2 ARG A 104 3.151 2.760 -27.488 1.00 0.00 H new ATOM 0 HB3 ARG A 104 3.955 1.271 -27.944 1.00 0.00 H new ATOM 0 HG2 ARG A 104 3.492 1.729 -30.324 1.00 0.00 H new ATOM 0 HG3 ARG A 104 2.634 3.194 -29.890 1.00 0.00 H new ATOM 0 HD2 ARG A 104 4.679 4.093 -28.869 1.00 0.00 H new ATOM 0 HD3 ARG A 104 5.539 2.626 -29.294 1.00 0.00 H new ATOM 0 HE ARG A 104 4.372 3.631 -31.672 1.00 0.00 H new ATOM 0 HH11 ARG A 104 6.819 4.551 -29.307 1.00 0.00 H new ATOM 0 HH12 ARG A 104 7.767 5.484 -30.470 1.00 0.00 H new ATOM 0 HH21 ARG A 104 5.597 4.833 -33.157 1.00 0.00 H new ATOM 0 HH22 ARG A 104 7.079 5.644 -32.641 1.00 0.00 H new ATOM 1738 N VAL A 105 1.482 1.087 -25.717 1.00 0.00 N ATOM 1739 CA VAL A 105 1.307 0.424 -24.430 1.00 0.00 C ATOM 1740 C VAL A 105 0.224 -0.644 -24.504 1.00 0.00 C ATOM 1741 O VAL A 105 0.397 -1.753 -23.999 1.00 0.00 O ATOM 1742 CB VAL A 105 0.937 1.453 -23.345 1.00 0.00 C ATOM 1743 CG1 VAL A 105 0.510 0.748 -22.067 1.00 0.00 C ATOM 1744 CG2 VAL A 105 2.117 2.376 -23.083 1.00 0.00 C ATOM 0 H VAL A 105 1.342 2.097 -25.692 1.00 0.00 H new ATOM 0 HA VAL A 105 2.252 -0.055 -24.172 1.00 0.00 H new ATOM 0 HB VAL A 105 0.097 2.052 -23.697 1.00 0.00 H new ATOM 0 HG11 VAL A 105 0.252 1.490 -21.311 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -0.358 0.120 -22.270 1.00 0.00 H new ATOM 0 HG13 VAL A 105 1.329 0.128 -21.702 1.00 0.00 H new ATOM 0 HG21 VAL A 105 1.848 3.101 -22.315 1.00 0.00 H new ATOM 0 HG22 VAL A 105 2.970 1.788 -22.745 1.00 0.00 H new ATOM 0 HG23 VAL A 105 2.379 2.901 -24.002 1.00 0.00 H new ATOM 1754 N VAL A 106 -0.894 -0.303 -25.135 1.00 0.00 N ATOM 1755 CA VAL A 106 -1.996 -1.243 -25.304 1.00 0.00 C ATOM 1756 C VAL A 106 -1.592 -2.412 -26.192 1.00 0.00 C ATOM 1757 O VAL A 106 -1.927 -3.563 -25.910 1.00 0.00 O ATOM 1758 CB VAL A 106 -3.216 -0.532 -25.920 1.00 0.00 C ATOM 1759 CG1 VAL A 106 -4.306 -1.538 -26.256 1.00 0.00 C ATOM 1760 CG2 VAL A 106 -3.737 0.527 -24.960 1.00 0.00 C ATOM 0 H VAL A 106 -1.061 0.619 -25.538 1.00 0.00 H new ATOM 0 HA VAL A 106 -2.257 -1.628 -24.318 1.00 0.00 H new ATOM 0 HB VAL A 106 -2.911 -0.044 -26.846 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -5.160 -1.018 -26.690 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -3.922 -2.265 -26.971 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -4.618 -2.053 -25.348 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -4.600 1.026 -25.402 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -4.032 0.055 -24.023 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -2.954 1.260 -24.767 1.00 0.00 H new ATOM 1770 N ASN A 107 -0.870 -2.111 -27.266 1.00 0.00 N ATOM 1771 CA ASN A 107 -0.398 -3.140 -28.185 1.00 0.00 C ATOM 1772 C ASN A 107 0.512 -4.135 -27.476 1.00 0.00 C ATOM 1773 O ASN A 107 0.463 -5.336 -27.744 1.00 0.00 O ATOM 1774 CB ASN A 107 0.316 -2.512 -29.368 1.00 0.00 C ATOM 1775 CG ASN A 107 -0.635 -1.882 -30.348 1.00 0.00 C ATOM 1776 OD1 ASN A 107 -1.834 -2.185 -30.352 1.00 0.00 O ATOM 1777 ND2 ASN A 107 -0.124 -1.009 -31.178 1.00 0.00 N ATOM 0 H ASN A 107 -0.599 -1.162 -27.522 1.00 0.00 H new ATOM 0 HA ASN A 107 -1.267 -3.685 -28.554 1.00 0.00 H new ATOM 0 HB2 ASN A 107 1.014 -1.756 -29.007 1.00 0.00 H new ATOM 0 HB3 ASN A 107 0.906 -3.274 -29.878 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -0.721 -0.548 -31.864 1.00 0.00 H new ATOM 0 HD22 ASN A 107 0.871 -0.790 -31.139 1.00 0.00 H new ATOM 1784 N ILE A 108 1.343 -3.629 -26.572 1.00 0.00 N ATOM 1785 CA ILE A 108 2.197 -4.482 -25.754 1.00 0.00 C ATOM 1786 C ILE A 108 1.370 -5.450 -24.917 1.00 0.00 C ATOM 1787 O ILE A 108 1.653 -6.647 -24.873 1.00 0.00 O ATOM 1788 CB ILE A 108 3.092 -3.638 -24.828 1.00 0.00 C ATOM 1789 CG1 ILE A 108 4.140 -2.879 -25.646 1.00 0.00 C ATOM 1790 CG2 ILE A 108 3.762 -4.520 -23.786 1.00 0.00 C ATOM 1791 CD1 ILE A 108 4.853 -1.795 -24.870 1.00 0.00 C ATOM 0 H ILE A 108 1.444 -2.631 -26.387 1.00 0.00 H new ATOM 0 HA ILE A 108 2.827 -5.056 -26.433 1.00 0.00 H new ATOM 0 HB ILE A 108 2.467 -2.911 -24.310 1.00 0.00 H new ATOM 0 HG12 ILE A 108 4.877 -3.588 -26.022 1.00 0.00 H new ATOM 0 HG13 ILE A 108 3.656 -2.432 -26.514 1.00 0.00 H new ATOM 0 HG21 ILE A 108 4.391 -3.907 -23.140 1.00 0.00 H new ATOM 0 HG22 ILE A 108 3.000 -5.016 -23.185 1.00 0.00 H new ATOM 0 HG23 ILE A 108 4.376 -5.270 -24.285 1.00 0.00 H new ATOM 0 HD11 ILE A 108 5.580 -1.303 -25.516 1.00 0.00 H new ATOM 0 HD12 ILE A 108 4.127 -1.063 -24.517 1.00 0.00 H new ATOM 0 HD13 ILE A 108 5.367 -2.237 -24.017 1.00 0.00 H new ATOM 1803 N LEU A 109 0.346 -4.924 -24.254 1.00 0.00 N ATOM 1804 CA LEU A 109 -0.507 -5.735 -23.392 1.00 0.00 C ATOM 1805 C LEU A 109 -1.258 -6.789 -24.195 1.00 0.00 C ATOM 1806 O LEU A 109 -1.482 -7.902 -23.720 1.00 0.00 O ATOM 1807 CB LEU A 109 -1.506 -4.843 -22.645 1.00 0.00 C ATOM 1808 CG LEU A 109 -0.898 -3.866 -21.632 1.00 0.00 C ATOM 1809 CD1 LEU A 109 -1.969 -2.892 -21.158 1.00 0.00 C ATOM 1810 CD2 LEU A 109 -0.312 -4.645 -20.464 1.00 0.00 C ATOM 0 H LEU A 109 0.086 -3.939 -24.297 1.00 0.00 H new ATOM 0 HA LEU A 109 0.133 -6.244 -22.671 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -2.073 -4.270 -23.379 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -2.217 -5.483 -22.123 1.00 0.00 H new ATOM 0 HG LEU A 109 -0.097 -3.294 -22.101 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -1.536 -2.198 -20.438 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -2.357 -2.335 -22.011 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -2.781 -3.445 -20.686 1.00 0.00 H new ATOM 0 HD21 LEU A 109 0.120 -3.950 -19.744 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -1.099 -5.225 -19.982 1.00 0.00 H new ATOM 0 HD23 LEU A 109 0.463 -5.319 -20.829 1.00 0.00 H new ATOM 1822 N LYS A 110 -1.645 -6.431 -25.415 1.00 0.00 N ATOM 1823 CA LYS A 110 -2.430 -7.321 -26.262 1.00 0.00 C ATOM 1824 C LYS A 110 -1.541 -8.337 -26.968 1.00 0.00 C ATOM 1825 O LYS A 110 -1.768 -9.543 -26.878 1.00 0.00 O ATOM 1826 CB LYS A 110 -3.229 -6.517 -27.289 1.00 0.00 C ATOM 1827 CG LYS A 110 -4.114 -7.360 -28.197 1.00 0.00 C ATOM 1828 CD LYS A 110 -4.929 -6.487 -29.140 1.00 0.00 C ATOM 1829 CE LYS A 110 -5.848 -7.325 -30.017 1.00 0.00 C ATOM 1830 NZ LYS A 110 -6.652 -6.484 -30.943 1.00 0.00 N ATOM 0 H LYS A 110 -1.427 -5.529 -25.839 1.00 0.00 H new ATOM 0 HA LYS A 110 -3.124 -7.864 -25.621 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -3.853 -5.795 -26.762 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -2.535 -5.947 -27.906 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -3.496 -8.046 -28.776 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -4.785 -7.969 -27.591 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -5.522 -5.779 -28.561 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -4.258 -5.902 -29.768 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -5.253 -8.033 -30.594 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -6.517 -7.911 -29.386 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -7.347 -7.079 -31.437 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -7.149 -5.748 -30.401 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -6.023 -6.036 -31.639 1.00 0.00 H new ATOM 1844 N GLU A 111 -0.528 -7.841 -27.670 1.00 0.00 N ATOM 1845 CA GLU A 111 0.273 -8.679 -28.554 1.00 0.00 C ATOM 1846 C GLU A 111 1.054 -9.723 -27.766 1.00 0.00 C ATOM 1847 O GLU A 111 1.256 -10.844 -28.232 1.00 0.00 O ATOM 1848 CB GLU A 111 1.238 -7.819 -29.374 1.00 0.00 C ATOM 1849 CG GLU A 111 0.565 -6.943 -30.421 1.00 0.00 C ATOM 1850 CD GLU A 111 1.532 -6.049 -31.146 1.00 0.00 C ATOM 1851 OE1 GLU A 111 2.689 -6.054 -30.800 1.00 0.00 O ATOM 1852 OE2 GLU A 111 1.114 -5.362 -32.048 1.00 0.00 O ATOM 0 H GLU A 111 -0.242 -6.862 -27.644 1.00 0.00 H new ATOM 0 HA GLU A 111 -0.408 -9.197 -29.229 1.00 0.00 H new ATOM 0 HB2 GLU A 111 1.805 -7.182 -28.695 1.00 0.00 H new ATOM 0 HB3 GLU A 111 1.955 -8.472 -29.871 1.00 0.00 H new ATOM 0 HG2 GLU A 111 0.053 -7.578 -31.144 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -0.197 -6.330 -29.939 1.00 0.00 H new ATOM 1859 N ARG A 112 1.490 -9.348 -26.568 1.00 0.00 N ATOM 1860 CA ARG A 112 2.263 -10.246 -25.718 1.00 0.00 C ATOM 1861 C ARG A 112 1.350 -11.114 -24.861 1.00 0.00 C ATOM 1862 O ARG A 112 1.819 -11.902 -24.039 1.00 0.00 O ATOM 1863 CB ARG A 112 3.201 -9.457 -24.817 1.00 0.00 C ATOM 1864 CG ARG A 112 4.303 -8.704 -25.544 1.00 0.00 C ATOM 1865 CD ARG A 112 5.222 -8.025 -24.596 1.00 0.00 C ATOM 1866 NE ARG A 112 6.275 -7.298 -25.287 1.00 0.00 N ATOM 1867 CZ ARG A 112 7.229 -6.568 -24.676 1.00 0.00 C ATOM 1868 NH1 ARG A 112 7.249 -6.478 -23.365 1.00 0.00 N ATOM 1869 NH2 ARG A 112 8.144 -5.943 -25.396 1.00 0.00 N ATOM 0 H ARG A 112 1.321 -8.427 -26.163 1.00 0.00 H new ATOM 0 HA ARG A 112 2.849 -10.892 -26.372 1.00 0.00 H new ATOM 0 HB2 ARG A 112 2.613 -8.743 -24.240 1.00 0.00 H new ATOM 0 HB3 ARG A 112 3.659 -10.143 -24.104 1.00 0.00 H new ATOM 0 HG2 ARG A 112 4.869 -9.398 -26.166 1.00 0.00 H new ATOM 0 HG3 ARG A 112 3.860 -7.966 -26.213 1.00 0.00 H new ATOM 0 HD2 ARG A 112 4.654 -7.335 -23.972 1.00 0.00 H new ATOM 0 HD3 ARG A 112 5.668 -8.764 -23.930 1.00 0.00 H new ATOM 0 HE ARG A 112 6.293 -7.344 -26.306 1.00 0.00 H new ATOM 0 HH11 ARG A 112 6.542 -6.961 -22.810 1.00 0.00 H new ATOM 0 HH12 ARG A 112 7.971 -5.925 -22.903 1.00 0.00 H new ATOM 0 HH21 ARG A 112 8.128 -6.013 -26.413 1.00 0.00 H new ATOM 0 HH22 ARG A 112 8.866 -5.390 -24.934 1.00 0.00 H new ATOM 1883 N ASN A 113 0.045 -10.964 -25.057 1.00 0.00 N ATOM 1884 CA ASN A 113 -0.936 -11.765 -24.333 1.00 0.00 C ATOM 1885 C ASN A 113 -0.768 -11.612 -22.827 1.00 0.00 C ATOM 1886 O ASN A 113 -0.889 -12.582 -22.078 1.00 0.00 O ATOM 1887 CB ASN A 113 -0.835 -13.224 -24.737 1.00 0.00 C ATOM 1888 CG ASN A 113 -1.178 -13.449 -26.183 1.00 0.00 C ATOM 1889 OD1 ASN A 113 -2.148 -12.883 -26.699 1.00 0.00 O ATOM 1890 ND2 ASN A 113 -0.399 -14.264 -26.848 1.00 0.00 N ATOM 0 H ASN A 113 -0.359 -10.294 -25.712 1.00 0.00 H new ATOM 0 HA ASN A 113 -1.929 -11.400 -24.597 1.00 0.00 H new ATOM 0 HB2 ASN A 113 0.178 -13.580 -24.548 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -1.503 -13.817 -24.112 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -0.582 -14.454 -27.833 1.00 0.00 H new ATOM 0 HD22 ASN A 113 0.391 -14.709 -26.381 1.00 0.00 H new ATOM 1897 N ILE A 114 -0.488 -10.390 -22.389 1.00 0.00 N ATOM 1898 CA ILE A 114 -0.303 -10.108 -20.970 1.00 0.00 C ATOM 1899 C ILE A 114 -1.637 -10.076 -20.236 1.00 0.00 C ATOM 1900 O ILE A 114 -1.796 -10.705 -19.190 1.00 0.00 O ATOM 1901 CB ILE A 114 0.428 -8.768 -20.767 1.00 0.00 C ATOM 1902 CG1 ILE A 114 1.863 -8.858 -21.291 1.00 0.00 C ATOM 1903 CG2 ILE A 114 0.417 -8.374 -19.298 1.00 0.00 C ATOM 1904 CD1 ILE A 114 2.566 -7.522 -21.379 1.00 0.00 C ATOM 0 H ILE A 114 -0.384 -9.578 -22.997 1.00 0.00 H new ATOM 0 HA ILE A 114 0.305 -10.912 -20.556 1.00 0.00 H new ATOM 0 HB ILE A 114 -0.096 -7.997 -21.332 1.00 0.00 H new ATOM 0 HG12 ILE A 114 2.437 -9.518 -20.640 1.00 0.00 H new ATOM 0 HG13 ILE A 114 1.851 -9.317 -22.279 1.00 0.00 H new ATOM 0 HG21 ILE A 114 0.938 -7.425 -19.172 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -0.613 -8.271 -18.957 1.00 0.00 H new ATOM 0 HG23 ILE A 114 0.918 -9.144 -18.711 1.00 0.00 H new ATOM 0 HD11 ILE A 114 3.577 -7.667 -21.758 1.00 0.00 H new ATOM 0 HD12 ILE A 114 2.016 -6.865 -22.053 1.00 0.00 H new ATOM 0 HD13 ILE A 114 2.612 -7.069 -20.389 1.00 0.00 H new ATOM 1916 N PHE A 115 -2.594 -9.340 -20.791 1.00 0.00 N ATOM 1917 CA PHE A 115 -3.950 -9.317 -20.256 1.00 0.00 C ATOM 1918 C PHE A 115 -4.875 -10.221 -21.060 1.00 0.00 C ATOM 1919 O PHE A 115 -4.619 -10.504 -22.231 1.00 0.00 O ATOM 1920 CB PHE A 115 -4.500 -7.890 -20.253 1.00 0.00 C ATOM 1921 CG PHE A 115 -3.849 -6.992 -19.239 1.00 0.00 C ATOM 1922 CD1 PHE A 115 -3.133 -7.525 -18.177 1.00 0.00 C ATOM 1923 CD2 PHE A 115 -3.952 -5.613 -19.344 1.00 0.00 C ATOM 1924 CE1 PHE A 115 -2.534 -6.700 -17.244 1.00 0.00 C ATOM 1925 CE2 PHE A 115 -3.354 -4.786 -18.413 1.00 0.00 C ATOM 1926 CZ PHE A 115 -2.644 -5.331 -17.362 1.00 0.00 C ATOM 0 H PHE A 115 -2.455 -8.751 -21.612 1.00 0.00 H new ATOM 0 HA PHE A 115 -3.908 -9.688 -19.232 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -4.369 -7.458 -21.245 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -5.572 -7.924 -20.059 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -3.043 -8.597 -18.078 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -4.506 -5.180 -20.164 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -1.979 -7.128 -16.422 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -3.442 -3.714 -18.507 1.00 0.00 H new ATOM 0 HZ PHE A 115 -2.176 -4.686 -16.633 1.00 0.00 H new ATOM 1936 N SER A 116 -5.953 -10.672 -20.427 1.00 0.00 N ATOM 1937 CA SER A 116 -6.887 -11.592 -21.063 1.00 0.00 C ATOM 1938 C SER A 116 -7.653 -10.909 -22.188 1.00 0.00 C ATOM 1939 O SER A 116 -7.715 -9.681 -22.254 1.00 0.00 O ATOM 1940 CB SER A 116 -7.860 -12.140 -20.037 1.00 0.00 C ATOM 1941 OG SER A 116 -8.741 -11.144 -19.598 1.00 0.00 O ATOM 0 H SER A 116 -6.201 -10.414 -19.472 1.00 0.00 H new ATOM 0 HA SER A 116 -6.312 -12.413 -21.491 1.00 0.00 H new ATOM 0 HB2 SER A 116 -8.425 -12.965 -20.471 1.00 0.00 H new ATOM 0 HB3 SER A 116 -7.309 -12.543 -19.187 1.00 0.00 H new ATOM 0 HG SER A 116 -9.360 -11.522 -18.938 1.00 0.00 H new ATOM 1947 N LYS A 117 -8.236 -11.711 -23.073 1.00 0.00 N ATOM 1948 CA LYS A 117 -8.997 -11.185 -24.200 1.00 0.00 C ATOM 1949 C LYS A 117 -10.172 -10.340 -23.725 1.00 0.00 C ATOM 1950 O LYS A 117 -10.532 -9.348 -24.358 1.00 0.00 O ATOM 1951 CB LYS A 117 -9.494 -12.325 -25.090 1.00 0.00 C ATOM 1952 CG LYS A 117 -8.398 -13.032 -25.877 1.00 0.00 C ATOM 1953 CD LYS A 117 -8.967 -14.163 -26.721 1.00 0.00 C ATOM 1954 CE LYS A 117 -7.872 -14.876 -27.502 1.00 0.00 C ATOM 1955 NZ LYS A 117 -8.408 -16.009 -28.303 1.00 0.00 N ATOM 0 H LYS A 117 -8.196 -12.729 -23.031 1.00 0.00 H new ATOM 0 HA LYS A 117 -8.332 -10.547 -24.782 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -10.008 -13.058 -24.468 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -10.230 -11.929 -25.790 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -7.889 -12.315 -26.521 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -7.651 -13.429 -25.189 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -9.481 -14.877 -26.077 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -9.710 -13.765 -27.413 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -7.377 -14.165 -28.164 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -7.116 -15.247 -26.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -7.630 -16.468 -28.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -8.858 -16.700 -27.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -9.111 -15.653 -28.981 1.00 0.00 H new ATOM 1969 N GLN A 118 -10.767 -10.740 -22.607 1.00 0.00 N ATOM 1970 CA GLN A 118 -11.829 -9.960 -21.983 1.00 0.00 C ATOM 1971 C GLN A 118 -11.348 -8.558 -21.630 1.00 0.00 C ATOM 1972 O GLN A 118 -12.002 -7.567 -21.953 1.00 0.00 O ATOM 1973 CB GLN A 118 -12.347 -10.666 -20.727 1.00 0.00 C ATOM 1974 CG GLN A 118 -13.419 -9.896 -19.976 1.00 0.00 C ATOM 1975 CD GLN A 118 -14.696 -9.747 -20.782 1.00 0.00 C ATOM 1976 OE1 GLN A 118 -15.191 -10.711 -21.372 1.00 0.00 O ATOM 1977 NE2 GLN A 118 -15.238 -8.534 -20.812 1.00 0.00 N ATOM 0 H GLN A 118 -10.532 -11.601 -22.114 1.00 0.00 H new ATOM 0 HA GLN A 118 -12.643 -9.872 -22.703 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -12.746 -11.640 -21.010 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -11.509 -10.848 -20.055 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -13.641 -10.408 -19.040 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -13.039 -8.908 -19.717 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -14.795 -7.765 -20.309 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -16.097 -8.372 -21.338 1.00 0.00 H new ATOM 1986 N VAL A 119 -10.200 -8.482 -20.964 1.00 0.00 N ATOM 1987 CA VAL A 119 -9.623 -7.201 -20.577 1.00 0.00 C ATOM 1988 C VAL A 119 -9.281 -6.358 -21.800 1.00 0.00 C ATOM 1989 O VAL A 119 -9.584 -5.166 -21.848 1.00 0.00 O ATOM 1990 CB VAL A 119 -8.350 -7.420 -19.737 1.00 0.00 C ATOM 1991 CG1 VAL A 119 -7.616 -6.104 -19.529 1.00 0.00 C ATOM 1992 CG2 VAL A 119 -8.714 -8.052 -18.402 1.00 0.00 C ATOM 0 H VAL A 119 -9.651 -9.294 -20.681 1.00 0.00 H new ATOM 0 HA VAL A 119 -10.367 -6.669 -19.983 1.00 0.00 H new ATOM 0 HB VAL A 119 -7.684 -8.096 -20.273 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -6.720 -6.278 -18.934 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -7.334 -5.688 -20.496 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -8.267 -5.402 -19.008 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -7.810 -8.204 -17.813 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -9.393 -7.393 -17.861 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -9.200 -9.012 -18.575 1.00 0.00 H new ATOM 2002 N VAL A 120 -8.650 -6.985 -22.786 1.00 0.00 N ATOM 2003 CA VAL A 120 -8.254 -6.291 -24.006 1.00 0.00 C ATOM 2004 C VAL A 120 -9.461 -5.690 -24.714 1.00 0.00 C ATOM 2005 O VAL A 120 -9.427 -4.540 -25.151 1.00 0.00 O ATOM 2006 CB VAL A 120 -7.532 -7.260 -24.962 1.00 0.00 C ATOM 2007 CG1 VAL A 120 -7.347 -6.619 -26.329 1.00 0.00 C ATOM 2008 CG2 VAL A 120 -6.191 -7.666 -24.370 1.00 0.00 C ATOM 0 H VAL A 120 -8.401 -7.974 -22.765 1.00 0.00 H new ATOM 0 HA VAL A 120 -7.578 -5.484 -23.723 1.00 0.00 H new ATOM 0 HB VAL A 120 -8.142 -8.154 -25.089 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -6.835 -7.317 -26.992 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -8.321 -6.368 -26.748 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -6.751 -5.712 -26.228 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -5.685 -8.351 -25.050 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -5.574 -6.779 -24.223 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -6.351 -8.159 -23.411 1.00 0.00 H new ATOM 2018 N ASN A 121 -10.528 -6.475 -24.824 1.00 0.00 N ATOM 2019 CA ASN A 121 -11.759 -6.010 -25.451 1.00 0.00 C ATOM 2020 C ASN A 121 -12.362 -4.840 -24.684 1.00 0.00 C ATOM 2021 O ASN A 121 -12.871 -3.891 -25.280 1.00 0.00 O ATOM 2022 CB ASN A 121 -12.761 -7.145 -25.567 1.00 0.00 C ATOM 2023 CG ASN A 121 -12.388 -8.138 -26.632 1.00 0.00 C ATOM 2024 OD1 ASN A 121 -11.595 -7.835 -27.532 1.00 0.00 O ATOM 2025 ND2 ASN A 121 -12.943 -9.320 -26.549 1.00 0.00 N ATOM 0 H ASN A 121 -10.564 -7.437 -24.487 1.00 0.00 H new ATOM 0 HA ASN A 121 -11.512 -5.661 -26.454 1.00 0.00 H new ATOM 0 HB2 ASN A 121 -12.837 -7.657 -24.608 1.00 0.00 H new ATOM 0 HB3 ASN A 121 -13.746 -6.734 -25.787 1.00 0.00 H new ATOM 0 HD21 ASN A 121 -12.727 -10.035 -27.244 1.00 0.00 H new ATOM 0 HD22 ASN A 121 -13.592 -9.527 -25.789 1.00 0.00 H new ATOM 2032 N ASP A 122 -12.300 -4.914 -23.359 1.00 0.00 N ATOM 2033 CA ASP A 122 -12.802 -3.842 -22.508 1.00 0.00 C ATOM 2034 C ASP A 122 -11.965 -2.578 -22.661 1.00 0.00 C ATOM 2035 O ASP A 122 -12.491 -1.466 -22.627 1.00 0.00 O ATOM 2036 CB ASP A 122 -12.811 -4.280 -21.042 1.00 0.00 C ATOM 2037 CG ASP A 122 -13.891 -5.310 -20.738 1.00 0.00 C ATOM 2038 OD1 ASP A 122 -14.851 -5.369 -21.469 1.00 0.00 O ATOM 2039 OD2 ASP A 122 -13.746 -6.028 -19.777 1.00 0.00 O ATOM 0 H ASP A 122 -11.907 -5.706 -22.851 1.00 0.00 H new ATOM 0 HA ASP A 122 -13.822 -3.621 -22.823 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -11.837 -4.696 -20.786 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -12.961 -3.406 -20.408 1.00 0.00 H new ATOM 2044 N ILE A 123 -10.659 -2.757 -22.830 1.00 0.00 N ATOM 2045 CA ILE A 123 -9.759 -1.637 -23.077 1.00 0.00 C ATOM 2046 C ILE A 123 -10.078 -0.956 -24.402 1.00 0.00 C ATOM 2047 O ILE A 123 -10.224 0.265 -24.463 1.00 0.00 O ATOM 2048 CB ILE A 123 -8.291 -2.103 -23.080 1.00 0.00 C ATOM 2049 CG1 ILE A 123 -7.863 -2.527 -21.673 1.00 0.00 C ATOM 2050 CG2 ILE A 123 -7.384 -1.001 -23.606 1.00 0.00 C ATOM 2051 CD1 ILE A 123 -6.551 -3.277 -21.633 1.00 0.00 C ATOM 0 H ILE A 123 -10.200 -3.668 -22.800 1.00 0.00 H new ATOM 0 HA ILE A 123 -9.904 -0.920 -22.269 1.00 0.00 H new ATOM 0 HB ILE A 123 -8.202 -2.965 -23.741 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -7.782 -1.640 -21.045 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -8.642 -3.154 -21.240 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -6.350 -1.347 -23.601 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -7.676 -0.744 -24.624 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -7.475 -0.121 -22.970 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -6.315 -3.543 -20.603 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -6.632 -4.184 -22.233 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -5.759 -2.646 -22.035 1.00 0.00 H new ATOM 2063 N GLU A 124 -10.186 -1.752 -25.460 1.00 0.00 N ATOM 2064 CA GLU A 124 -10.411 -1.220 -26.799 1.00 0.00 C ATOM 2065 C GLU A 124 -11.745 -0.489 -26.885 1.00 0.00 C ATOM 2066 O GLU A 124 -11.853 0.552 -27.533 1.00 0.00 O ATOM 2067 CB GLU A 124 -10.368 -2.346 -27.834 1.00 0.00 C ATOM 2068 CG GLU A 124 -8.983 -2.936 -28.064 1.00 0.00 C ATOM 2069 CD GLU A 124 -8.983 -4.051 -29.072 1.00 0.00 C ATOM 2070 OE1 GLU A 124 -10.042 -4.429 -29.512 1.00 0.00 O ATOM 2071 OE2 GLU A 124 -7.921 -4.525 -29.403 1.00 0.00 O ATOM 0 H GLU A 124 -10.121 -2.769 -25.416 1.00 0.00 H new ATOM 0 HA GLU A 124 -9.615 -0.507 -27.012 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -11.040 -3.142 -27.515 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -10.750 -1.967 -28.782 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -8.309 -2.148 -28.401 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -8.590 -3.308 -27.118 1.00 0.00 H new ATOM 2078 N ARG A 125 -12.759 -1.040 -26.227 1.00 0.00 N ATOM 2079 CA ARG A 125 -14.067 -0.399 -26.158 1.00 0.00 C ATOM 2080 C ARG A 125 -13.993 0.924 -25.407 1.00 0.00 C ATOM 2081 O ARG A 125 -14.572 1.924 -25.832 1.00 0.00 O ATOM 2082 CB ARG A 125 -15.075 -1.311 -25.476 1.00 0.00 C ATOM 2083 CG ARG A 125 -16.508 -0.803 -25.488 1.00 0.00 C ATOM 2084 CD ARG A 125 -17.448 -1.797 -24.910 1.00 0.00 C ATOM 2085 NE ARG A 125 -17.250 -1.962 -23.479 1.00 0.00 N ATOM 2086 CZ ARG A 125 -16.668 -3.033 -22.906 1.00 0.00 C ATOM 2087 NH1 ARG A 125 -16.232 -4.023 -23.653 1.00 0.00 N ATOM 2088 NH2 ARG A 125 -16.534 -3.089 -21.592 1.00 0.00 N ATOM 0 H ARG A 125 -12.700 -1.930 -25.733 1.00 0.00 H new ATOM 0 HA ARG A 125 -14.390 -0.204 -27.180 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -15.047 -2.287 -25.961 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -14.766 -1.460 -24.441 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -16.569 0.127 -24.923 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -16.804 -0.574 -26.512 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -18.473 -1.480 -25.101 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -17.313 -2.757 -25.408 1.00 0.00 H new ATOM 0 HE ARG A 125 -17.575 -1.214 -22.866 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -16.334 -3.980 -24.667 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -15.791 -4.834 -23.219 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -16.871 -2.321 -21.012 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -16.093 -3.900 -21.158 1.00 0.00 H new ATOM 2102 N SER A 126 -13.278 0.923 -24.287 1.00 0.00 N ATOM 2103 CA SER A 126 -13.097 2.133 -23.493 1.00 0.00 C ATOM 2104 C SER A 126 -12.357 3.205 -24.283 1.00 0.00 C ATOM 2105 O SER A 126 -12.686 4.388 -24.200 1.00 0.00 O ATOM 2106 CB SER A 126 -12.335 1.813 -22.221 1.00 0.00 C ATOM 2107 OG SER A 126 -13.074 0.956 -21.396 1.00 0.00 O ATOM 0 H SER A 126 -12.814 0.097 -23.908 1.00 0.00 H new ATOM 0 HA SER A 126 -14.084 2.518 -23.237 1.00 0.00 H new ATOM 0 HB2 SER A 126 -11.381 1.349 -22.471 1.00 0.00 H new ATOM 0 HB3 SER A 126 -12.111 2.735 -21.685 1.00 0.00 H new ATOM 0 HG SER A 126 -12.959 0.031 -21.699 1.00 0.00 H new ATOM 2113 N LEU A 127 -11.357 2.784 -25.049 1.00 0.00 N ATOM 2114 CA LEU A 127 -10.607 3.698 -25.902 1.00 0.00 C ATOM 2115 C LEU A 127 -11.506 4.329 -26.958 1.00 0.00 C ATOM 2116 O LEU A 127 -11.423 5.528 -27.222 1.00 0.00 O ATOM 2117 CB LEU A 127 -9.449 2.959 -26.583 1.00 0.00 C ATOM 2118 CG LEU A 127 -8.310 2.511 -25.658 1.00 0.00 C ATOM 2119 CD1 LEU A 127 -7.369 1.588 -26.421 1.00 0.00 C ATOM 2120 CD2 LEU A 127 -7.571 3.733 -25.133 1.00 0.00 C ATOM 0 H LEU A 127 -11.047 1.814 -25.097 1.00 0.00 H new ATOM 0 HA LEU A 127 -10.208 4.492 -25.271 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -9.850 2.080 -27.087 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -9.032 3.607 -27.354 1.00 0.00 H new ATOM 0 HG LEU A 127 -8.715 1.963 -24.807 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -6.560 1.270 -25.764 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -7.919 0.714 -26.769 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -6.953 2.119 -27.277 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -6.762 3.414 -24.476 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -7.158 4.296 -25.970 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -8.263 4.365 -24.576 1.00 0.00 H new ATOM 2132 N ALA A 128 -12.366 3.514 -27.559 1.00 0.00 N ATOM 2133 CA ALA A 128 -13.323 4.002 -28.544 1.00 0.00 C ATOM 2134 C ALA A 128 -14.306 4.983 -27.918 1.00 0.00 C ATOM 2135 O ALA A 128 -14.660 5.994 -28.525 1.00 0.00 O ATOM 2136 CB ALA A 128 -14.070 2.837 -29.179 1.00 0.00 C ATOM 0 H ALA A 128 -12.420 2.511 -27.381 1.00 0.00 H new ATOM 0 HA ALA A 128 -12.768 4.530 -29.319 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -14.781 3.217 -29.912 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -13.359 2.175 -29.673 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -14.605 2.284 -28.407 1.00 0.00 H new ATOM 2142 N ALA A 129 -14.744 4.679 -26.701 1.00 0.00 N ATOM 2143 CA ALA A 129 -15.646 5.560 -25.969 1.00 0.00 C ATOM 2144 C ALA A 129 -15.011 6.923 -25.730 1.00 0.00 C ATOM 2145 O ALA A 129 -15.677 7.954 -25.825 1.00 0.00 O ATOM 2146 CB ALA A 129 -16.049 4.924 -24.646 1.00 0.00 C ATOM 0 H ALA A 129 -14.488 3.828 -26.200 1.00 0.00 H new ATOM 0 HA ALA A 129 -16.539 5.707 -26.576 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -16.722 5.593 -24.111 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -16.554 3.977 -24.836 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -15.159 4.745 -24.042 1.00 0.00 H new ATOM 2152 N ALA A 130 -13.719 6.922 -25.418 1.00 0.00 N ATOM 2153 CA ALA A 130 -12.969 8.162 -25.256 1.00 0.00 C ATOM 2154 C ALA A 130 -12.890 8.934 -26.567 1.00 0.00 C ATOM 2155 O ALA A 130 -13.030 10.157 -26.588 1.00 0.00 O ATOM 2156 CB ALA A 130 -11.572 7.871 -24.728 1.00 0.00 C ATOM 0 H ALA A 130 -13.169 6.075 -25.272 1.00 0.00 H new ATOM 0 HA ALA A 130 -13.497 8.782 -24.532 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -11.025 8.806 -24.612 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -11.645 7.371 -23.762 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -11.044 7.226 -25.431 1.00 0.00 H new ATOM 2162 N LEU A 131 -12.665 8.212 -27.659 1.00 0.00 N ATOM 2163 CA LEU A 131 -12.586 8.826 -28.980 1.00 0.00 C ATOM 2164 C LEU A 131 -13.917 9.453 -29.376 1.00 0.00 C ATOM 2165 O LEU A 131 -13.953 10.465 -30.075 1.00 0.00 O ATOM 2166 CB LEU A 131 -12.175 7.782 -30.025 1.00 0.00 C ATOM 2167 CG LEU A 131 -10.733 7.268 -29.921 1.00 0.00 C ATOM 2168 CD1 LEU A 131 -10.532 6.116 -30.896 1.00 0.00 C ATOM 2169 CD2 LEU A 131 -9.766 8.406 -30.211 1.00 0.00 C ATOM 0 H LEU A 131 -12.534 7.200 -27.656 1.00 0.00 H new ATOM 0 HA LEU A 131 -11.833 9.613 -28.939 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -12.851 6.931 -29.947 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -12.317 8.212 -31.017 1.00 0.00 H new ATOM 0 HG LEU A 131 -10.540 6.902 -28.913 1.00 0.00 H new ATOM 0 HD11 LEU A 131 -9.508 5.751 -30.822 1.00 0.00 H new ATOM 0 HD12 LEU A 131 -11.223 5.309 -30.653 1.00 0.00 H new ATOM 0 HD13 LEU A 131 -10.721 6.462 -31.912 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -8.742 8.041 -30.137 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -9.944 8.787 -31.217 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -9.919 9.207 -29.487 1.00 0.00 H new ATOM 2181 N GLU A 132 -15.009 8.846 -28.924 1.00 0.00 N ATOM 2182 CA GLU A 132 -16.345 9.339 -29.237 1.00 0.00 C ATOM 2183 C GLU A 132 -16.944 10.094 -28.058 1.00 0.00 C ATOM 2184 O GLU A 132 -18.151 10.330 -28.008 1.00 0.00 O ATOM 2185 CB GLU A 132 -17.263 8.180 -29.632 1.00 0.00 C ATOM 2186 CG GLU A 132 -16.843 7.449 -30.900 1.00 0.00 C ATOM 2187 CD GLU A 132 -17.798 6.355 -31.288 1.00 0.00 C ATOM 2188 OE1 GLU A 132 -18.716 6.103 -30.545 1.00 0.00 O ATOM 2189 OE2 GLU A 132 -17.610 5.772 -32.330 1.00 0.00 O ATOM 0 H GLU A 132 -14.995 8.011 -28.339 1.00 0.00 H new ATOM 0 HA GLU A 132 -16.257 10.028 -30.077 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -17.299 7.465 -28.810 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -18.275 8.563 -29.766 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -16.767 8.165 -31.718 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -15.850 7.023 -30.756 1.00 0.00 H new ATOM 2196 N HIS A 133 -16.093 10.472 -27.110 1.00 0.00 N ATOM 2197 CA HIS A 133 -16.536 11.203 -25.929 1.00 0.00 C ATOM 2198 C HIS A 133 -16.785 12.671 -26.251 1.00 0.00 C ATOM 2199 O HIS A 133 -17.808 13.004 -26.781 1.00 0.00 O ATOM 2200 CB HIS A 133 -15.504 11.089 -24.802 1.00 0.00 C ATOM 2201 CG HIS A 133 -15.959 11.685 -23.507 1.00 0.00 C ATOM 2202 ND1 HIS A 133 -15.927 13.042 -23.261 1.00 0.00 N ATOM 2203 CD2 HIS A 133 -16.456 11.111 -22.386 1.00 0.00 C ATOM 2204 CE1 HIS A 133 -16.386 13.276 -22.044 1.00 0.00 C ATOM 2205 NE2 HIS A 133 -16.712 12.122 -21.493 1.00 0.00 N ATOM 0 H HIS A 133 -15.091 10.284 -27.137 1.00 0.00 H new ATOM 0 HA HIS A 133 -17.474 10.756 -25.599 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -15.266 10.037 -24.644 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -14.583 11.580 -25.114 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -16.620 10.056 -22.225 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -16.479 14.247 -21.579 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -17.093 12.001 -20.555 1.00 0.00 H new TER 2213 HIS A 133