USER MOD reduce.3.24.130724 H: found=0, std=0, add=911, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 910 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 76 SER OG : rot -136:sc= 0.635 USER MOD Set 1.2: A 78 TYR OH : rot 150:sc= -0.928! USER MOD Set 2.1: A 43 GLN : amide:sc= -1.76 K(o=-0.85,f=-2!) USER MOD Set 2.2: A 44 THR OG1 : rot 128:sc= 0.911 USER MOD Set 3.1: A 17 THR OG1 : rot -170:sc= 0.0968 USER MOD Set 3.2: A 101 ASN : amide:sc= -1.55! C(o=-1.5!,f=-4.9!) USER MOD Single : A 1 SER N :NH3+ 162:sc= 0.167 (180deg=-0.214) USER MOD Single : A 1 SER OG : rot 180:sc= 0.0716 USER MOD Single : A 3 GLN : amide:sc= 0 X(o=0,f=-0.0062) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 180:sc= -0.716! USER MOD Single : A 9 ASN : amide:sc= -0.253 K(o=-0.25,f=-2.4!) USER MOD Single : A 13 THR OG1 : rot -50:sc= 0.559 USER MOD Single : A 18 GLN : amide:sc= -2.21 K(o=-2.2,f=-4.2!) USER MOD Single : A 27 ASN : amide:sc= 0.208 K(o=0.21,f=-1.5!) USER MOD Single : A 28 THR OG1 : rot 180:sc=-0.00948 USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 71:sc= -8.95! USER MOD Single : A 38 THR OG1 : rot 180:sc= -1.95! USER MOD Single : A 41 GLN : amide:sc= -8.76! C(o=-8.8!,f=-8.5!) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 50 ASN : amide:sc= -1.01 K(o=-1,f=0.33) USER MOD Single : A 51 ASN : amide:sc= -3.4! C(o=-3.4!,f=-2.7!) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 66 HIS : no HD1:sc= -3.35! K(o=-3.4!,f=-2) USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot -81:sc= -0.78 USER MOD Single : A 80 LYS NZ :NH3+ -162:sc= 0.318 (180deg=0.205) USER MOD Single : A 81 LYS NZ :NH3+ -123:sc= -0.0115 (180deg=-0.239) USER MOD Single : A 83 SER OG : rot 180:sc= -0.0297 USER MOD Single : A 88 THR OG1 : rot -28:sc= 0.417 USER MOD Single : A 90 LYS NZ :NH3+ -133:sc= -0.579 (180deg=-1.59!) USER MOD Single : A 91 THR OG1 : rot -65:sc= 0.181 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot -164:sc= 0.444! USER MOD Single : A 100 TYR OH : rot 180:sc= -0.146 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 GLN : amide:sc= -0.019 X(o=-0.019,f=0) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 115 LYS NZ :NH3+ -164:sc= -0.0024 (180deg=-0.339) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= 0 X(o=0,f=-0.024) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 13.320 7.686 -0.890 1.00 0.00 N ATOM 2 CA SER A 1 11.940 8.103 -0.513 1.00 0.00 C ATOM 3 C SER A 1 10.927 7.156 -1.160 1.00 0.00 C ATOM 4 O SER A 1 9.779 7.503 -1.359 1.00 0.00 O ATOM 5 CB SER A 1 11.687 9.528 -1.004 1.00 0.00 C ATOM 6 OG SER A 1 12.914 10.249 -1.011 1.00 0.00 O ATOM 0 H1 SER A 1 13.979 8.472 -0.720 1.00 0.00 H new ATOM 0 H2 SER A 1 13.604 6.866 -0.316 1.00 0.00 H new ATOM 0 H3 SER A 1 13.342 7.428 -1.897 1.00 0.00 H new ATOM 0 HA SER A 1 11.833 8.066 0.571 1.00 0.00 H new ATOM 0 HB2 SER A 1 11.258 9.509 -2.006 1.00 0.00 H new ATOM 0 HB3 SER A 1 10.964 10.025 -0.357 1.00 0.00 H new ATOM 0 HG SER A 1 12.755 11.163 -1.327 1.00 0.00 H new ATOM 14 N TRP A 2 11.346 5.966 -1.501 1.00 0.00 N ATOM 15 CA TRP A 2 10.413 4.997 -2.146 1.00 0.00 C ATOM 16 C TRP A 2 10.245 5.359 -3.628 1.00 0.00 C ATOM 17 O TRP A 2 9.632 4.633 -4.385 1.00 0.00 O ATOM 18 CB TRP A 2 9.051 5.050 -1.448 1.00 0.00 C ATOM 19 CG TRP A 2 8.579 3.663 -1.124 1.00 0.00 C ATOM 20 CD1 TRP A 2 8.551 2.621 -1.989 1.00 0.00 C ATOM 21 CD2 TRP A 2 8.059 3.157 0.140 1.00 0.00 C ATOM 22 NE1 TRP A 2 8.042 1.509 -1.333 1.00 0.00 N ATOM 23 CE2 TRP A 2 7.726 1.790 -0.018 1.00 0.00 C ATOM 24 CE3 TRP A 2 7.848 3.750 1.397 1.00 0.00 C ATOM 25 CZ2 TRP A 2 7.196 1.038 1.036 1.00 0.00 C ATOM 26 CZ3 TRP A 2 7.319 2.997 2.458 1.00 0.00 C ATOM 27 CH2 TRP A 2 6.993 1.645 2.278 1.00 0.00 C ATOM 0 H TRP A 2 12.296 5.623 -1.360 1.00 0.00 H new ATOM 0 HA TRP A 2 10.822 3.990 -2.061 1.00 0.00 H new ATOM 0 HB2 TRP A 2 9.126 5.639 -0.534 1.00 0.00 H new ATOM 0 HB3 TRP A 2 8.325 5.548 -2.090 1.00 0.00 H new ATOM 0 HD1 TRP A 2 8.872 2.651 -3.020 1.00 0.00 H new ATOM 0 HE1 TRP A 2 7.917 0.595 -1.769 1.00 0.00 H new ATOM 0 HE3 TRP A 2 8.094 4.791 1.548 1.00 0.00 H new ATOM 0 HZ2 TRP A 2 6.946 -0.003 0.891 1.00 0.00 H new ATOM 0 HZ3 TRP A 2 7.162 3.463 3.420 1.00 0.00 H new ATOM 0 HH2 TRP A 2 6.585 1.073 3.099 1.00 0.00 H new ATOM 38 N GLN A 3 10.793 6.470 -4.053 1.00 0.00 N ATOM 39 CA GLN A 3 10.669 6.859 -5.488 1.00 0.00 C ATOM 40 C GLN A 3 11.659 6.033 -6.308 1.00 0.00 C ATOM 41 O GLN A 3 11.305 5.029 -6.900 1.00 0.00 O ATOM 42 CB GLN A 3 10.981 8.348 -5.647 1.00 0.00 C ATOM 43 CG GLN A 3 11.059 8.698 -7.134 1.00 0.00 C ATOM 44 CD GLN A 3 11.732 10.061 -7.301 1.00 0.00 C ATOM 45 OE1 GLN A 3 12.915 10.201 -7.062 1.00 0.00 O ATOM 46 NE2 GLN A 3 11.024 11.080 -7.705 1.00 0.00 N ATOM 0 H GLN A 3 11.319 7.121 -3.470 1.00 0.00 H new ATOM 0 HA GLN A 3 9.653 6.672 -5.837 1.00 0.00 H new ATOM 0 HB2 GLN A 3 10.209 8.946 -5.162 1.00 0.00 H new ATOM 0 HB3 GLN A 3 11.925 8.587 -5.156 1.00 0.00 H new ATOM 0 HG2 GLN A 3 11.622 7.934 -7.670 1.00 0.00 H new ATOM 0 HG3 GLN A 3 10.059 8.719 -7.567 1.00 0.00 H new ATOM 0 HE21 GLN A 3 10.031 10.963 -7.906 1.00 0.00 H new ATOM 0 HE22 GLN A 3 11.464 11.993 -7.820 1.00 0.00 H new ATOM 55 N THR A 4 12.905 6.426 -6.338 1.00 0.00 N ATOM 56 CA THR A 4 13.899 5.629 -7.105 1.00 0.00 C ATOM 57 C THR A 4 13.718 4.167 -6.703 1.00 0.00 C ATOM 58 O THR A 4 13.930 3.259 -7.479 1.00 0.00 O ATOM 59 CB THR A 4 15.318 6.092 -6.758 1.00 0.00 C ATOM 60 OG1 THR A 4 16.257 5.135 -7.229 1.00 0.00 O ATOM 61 CG2 THR A 4 15.457 6.242 -5.242 1.00 0.00 C ATOM 0 H THR A 4 13.272 7.255 -5.870 1.00 0.00 H new ATOM 0 HA THR A 4 13.751 5.756 -8.177 1.00 0.00 H new ATOM 0 HB THR A 4 15.509 7.054 -7.233 1.00 0.00 H new ATOM 0 HG1 THR A 4 17.165 5.431 -7.009 1.00 0.00 H new ATOM 0 HG21 THR A 4 16.468 6.571 -5.000 1.00 0.00 H new ATOM 0 HG22 THR A 4 14.739 6.979 -4.882 1.00 0.00 H new ATOM 0 HG23 THR A 4 15.263 5.283 -4.762 1.00 0.00 H new ATOM 69 N TYR A 5 13.296 3.951 -5.487 1.00 0.00 N ATOM 70 CA TYR A 5 13.060 2.568 -4.995 1.00 0.00 C ATOM 71 C TYR A 5 12.232 1.802 -6.030 1.00 0.00 C ATOM 72 O TYR A 5 12.612 0.743 -6.490 1.00 0.00 O ATOM 73 CB TYR A 5 12.286 2.643 -3.673 1.00 0.00 C ATOM 74 CG TYR A 5 13.248 2.706 -2.507 1.00 0.00 C ATOM 75 CD1 TYR A 5 14.597 3.021 -2.720 1.00 0.00 C ATOM 76 CD2 TYR A 5 12.789 2.446 -1.208 1.00 0.00 C ATOM 77 CE1 TYR A 5 15.484 3.076 -1.639 1.00 0.00 C ATOM 78 CE2 TYR A 5 13.677 2.500 -0.127 1.00 0.00 C ATOM 79 CZ TYR A 5 15.025 2.814 -0.343 1.00 0.00 C ATOM 80 OH TYR A 5 15.900 2.865 0.723 1.00 0.00 O ATOM 0 H TYR A 5 13.103 4.686 -4.806 1.00 0.00 H new ATOM 0 HA TYR A 5 14.009 2.055 -4.840 1.00 0.00 H new ATOM 0 HB2 TYR A 5 11.641 3.522 -3.670 1.00 0.00 H new ATOM 0 HB3 TYR A 5 11.638 1.772 -3.573 1.00 0.00 H new ATOM 0 HD1 TYR A 5 14.952 3.222 -3.720 1.00 0.00 H new ATOM 0 HD2 TYR A 5 11.750 2.204 -1.041 1.00 0.00 H new ATOM 0 HE1 TYR A 5 16.523 3.321 -1.805 1.00 0.00 H new ATOM 0 HE2 TYR A 5 13.323 2.300 0.873 1.00 0.00 H new ATOM 0 HH TYR A 5 15.419 2.659 1.551 1.00 0.00 H new ATOM 90 N VAL A 6 11.101 2.337 -6.399 1.00 0.00 N ATOM 91 CA VAL A 6 10.236 1.657 -7.403 1.00 0.00 C ATOM 92 C VAL A 6 11.073 1.281 -8.636 1.00 0.00 C ATOM 93 O VAL A 6 10.863 0.250 -9.245 1.00 0.00 O ATOM 94 CB VAL A 6 9.088 2.617 -7.789 1.00 0.00 C ATOM 95 CG1 VAL A 6 8.795 2.563 -9.296 1.00 0.00 C ATOM 96 CG2 VAL A 6 7.820 2.226 -7.024 1.00 0.00 C ATOM 0 H VAL A 6 10.737 3.222 -6.046 1.00 0.00 H new ATOM 0 HA VAL A 6 9.816 0.741 -6.988 1.00 0.00 H new ATOM 0 HB VAL A 6 9.395 3.631 -7.531 1.00 0.00 H new ATOM 0 HG11 VAL A 6 7.983 3.250 -9.534 1.00 0.00 H new ATOM 0 HG12 VAL A 6 9.688 2.851 -9.851 1.00 0.00 H new ATOM 0 HG13 VAL A 6 8.506 1.549 -9.574 1.00 0.00 H new ATOM 0 HG21 VAL A 6 7.009 2.902 -7.295 1.00 0.00 H new ATOM 0 HG22 VAL A 6 7.541 1.204 -7.280 1.00 0.00 H new ATOM 0 HG23 VAL A 6 8.006 2.294 -5.952 1.00 0.00 H new ATOM 106 N ASP A 7 11.993 2.118 -9.027 1.00 0.00 N ATOM 107 CA ASP A 7 12.809 1.813 -10.242 1.00 0.00 C ATOM 108 C ASP A 7 14.087 1.043 -9.895 1.00 0.00 C ATOM 109 O ASP A 7 15.165 1.416 -10.313 1.00 0.00 O ATOM 110 CB ASP A 7 13.198 3.121 -10.925 1.00 0.00 C ATOM 111 CG ASP A 7 13.249 2.915 -12.441 1.00 0.00 C ATOM 112 OD1 ASP A 7 14.285 2.489 -12.928 1.00 0.00 O ATOM 113 OD2 ASP A 7 12.252 3.188 -13.091 1.00 0.00 O ATOM 0 H ASP A 7 12.217 2.998 -8.562 1.00 0.00 H new ATOM 0 HA ASP A 7 12.204 1.191 -10.901 1.00 0.00 H new ATOM 0 HB2 ASP A 7 12.477 3.900 -10.678 1.00 0.00 H new ATOM 0 HB3 ASP A 7 14.169 3.458 -10.561 1.00 0.00 H new ATOM 118 N THR A 8 13.997 -0.035 -9.165 1.00 0.00 N ATOM 119 CA THR A 8 15.244 -0.799 -8.856 1.00 0.00 C ATOM 120 C THR A 8 14.976 -1.931 -7.860 1.00 0.00 C ATOM 121 O THR A 8 14.742 -3.061 -8.239 1.00 0.00 O ATOM 122 CB THR A 8 16.304 0.144 -8.278 1.00 0.00 C ATOM 123 OG1 THR A 8 17.149 -0.584 -7.398 1.00 0.00 O ATOM 124 CG2 THR A 8 15.630 1.281 -7.514 1.00 0.00 C ATOM 0 H THR A 8 13.135 -0.416 -8.775 1.00 0.00 H new ATOM 0 HA THR A 8 15.604 -1.238 -9.786 1.00 0.00 H new ATOM 0 HB THR A 8 16.895 0.564 -9.092 1.00 0.00 H new ATOM 0 HG1 THR A 8 17.830 0.016 -7.027 1.00 0.00 H new ATOM 0 HG21 THR A 8 16.391 1.947 -7.106 1.00 0.00 H new ATOM 0 HG22 THR A 8 14.983 1.840 -8.190 1.00 0.00 H new ATOM 0 HG23 THR A 8 15.034 0.869 -6.699 1.00 0.00 H new ATOM 132 N ASN A 9 15.052 -1.648 -6.590 1.00 0.00 N ATOM 133 CA ASN A 9 14.849 -2.721 -5.573 1.00 0.00 C ATOM 134 C ASN A 9 13.379 -2.837 -5.173 1.00 0.00 C ATOM 135 O ASN A 9 12.670 -3.676 -5.669 1.00 0.00 O ATOM 136 CB ASN A 9 15.678 -2.392 -4.332 1.00 0.00 C ATOM 137 CG ASN A 9 16.984 -3.187 -4.365 1.00 0.00 C ATOM 138 OD1 ASN A 9 17.337 -3.756 -5.379 1.00 0.00 O ATOM 139 ND2 ASN A 9 17.720 -3.250 -3.291 1.00 0.00 N ATOM 0 H ASN A 9 15.246 -0.721 -6.211 1.00 0.00 H new ATOM 0 HA ASN A 9 15.163 -3.670 -6.007 1.00 0.00 H new ATOM 0 HB2 ASN A 9 15.891 -1.324 -4.297 1.00 0.00 H new ATOM 0 HB3 ASN A 9 15.115 -2.635 -3.431 1.00 0.00 H new ATOM 0 HD21 ASN A 9 18.593 -3.777 -3.301 1.00 0.00 H new ATOM 0 HD22 ASN A 9 17.423 -2.772 -2.440 1.00 0.00 H new ATOM 146 N LEU A 10 12.949 -2.017 -4.250 1.00 0.00 N ATOM 147 CA LEU A 10 11.538 -2.057 -3.741 1.00 0.00 C ATOM 148 C LEU A 10 10.578 -2.740 -4.721 1.00 0.00 C ATOM 149 O LEU A 10 9.756 -3.543 -4.325 1.00 0.00 O ATOM 150 CB LEU A 10 11.060 -0.631 -3.487 1.00 0.00 C ATOM 151 CG LEU A 10 11.335 -0.261 -2.031 1.00 0.00 C ATOM 152 CD1 LEU A 10 10.623 -1.252 -1.108 1.00 0.00 C ATOM 153 CD2 LEU A 10 12.842 -0.318 -1.767 1.00 0.00 C ATOM 0 H LEU A 10 13.530 -1.301 -3.814 1.00 0.00 H new ATOM 0 HA LEU A 10 11.537 -2.641 -2.821 1.00 0.00 H new ATOM 0 HB2 LEU A 10 11.573 0.062 -4.154 1.00 0.00 H new ATOM 0 HB3 LEU A 10 9.994 -0.548 -3.701 1.00 0.00 H new ATOM 0 HG LEU A 10 10.967 0.747 -1.838 1.00 0.00 H new ATOM 0 HD11 LEU A 10 10.820 -0.987 -0.069 1.00 0.00 H new ATOM 0 HD12 LEU A 10 9.550 -1.216 -1.295 1.00 0.00 H new ATOM 0 HD13 LEU A 10 10.992 -2.259 -1.302 1.00 0.00 H new ATOM 0 HD21 LEU A 10 13.040 -0.054 -0.728 1.00 0.00 H new ATOM 0 HD22 LEU A 10 13.207 -1.326 -1.961 1.00 0.00 H new ATOM 0 HD23 LEU A 10 13.353 0.386 -2.424 1.00 0.00 H new ATOM 165 N VAL A 11 10.654 -2.436 -5.985 1.00 0.00 N ATOM 166 CA VAL A 11 9.714 -3.088 -6.943 1.00 0.00 C ATOM 167 C VAL A 11 10.300 -4.408 -7.445 1.00 0.00 C ATOM 168 O VAL A 11 9.698 -5.450 -7.277 1.00 0.00 O ATOM 169 CB VAL A 11 9.444 -2.159 -8.133 1.00 0.00 C ATOM 170 CG1 VAL A 11 8.776 -2.946 -9.265 1.00 0.00 C ATOM 171 CG2 VAL A 11 8.513 -1.029 -7.691 1.00 0.00 C ATOM 0 H VAL A 11 11.314 -1.775 -6.394 1.00 0.00 H new ATOM 0 HA VAL A 11 8.776 -3.289 -6.425 1.00 0.00 H new ATOM 0 HB VAL A 11 10.388 -1.745 -8.487 1.00 0.00 H new ATOM 0 HG11 VAL A 11 8.586 -2.281 -10.108 1.00 0.00 H new ATOM 0 HG12 VAL A 11 9.433 -3.756 -9.582 1.00 0.00 H new ATOM 0 HG13 VAL A 11 7.832 -3.362 -8.912 1.00 0.00 H new ATOM 0 HG21 VAL A 11 8.319 -0.367 -8.535 1.00 0.00 H new ATOM 0 HG22 VAL A 11 7.572 -1.450 -7.336 1.00 0.00 H new ATOM 0 HG23 VAL A 11 8.983 -0.464 -6.886 1.00 0.00 H new ATOM 181 N GLY A 12 11.454 -4.378 -8.069 1.00 0.00 N ATOM 182 CA GLY A 12 12.062 -5.647 -8.583 1.00 0.00 C ATOM 183 C GLY A 12 11.789 -6.764 -7.578 1.00 0.00 C ATOM 184 O GLY A 12 11.443 -7.873 -7.935 1.00 0.00 O ATOM 0 H GLY A 12 11.999 -3.534 -8.244 1.00 0.00 H new ATOM 0 HA2 GLY A 12 11.639 -5.902 -9.555 1.00 0.00 H new ATOM 0 HA3 GLY A 12 13.135 -5.521 -8.725 1.00 0.00 H new ATOM 188 N THR A 13 11.911 -6.447 -6.318 1.00 0.00 N ATOM 189 CA THR A 13 11.634 -7.432 -5.240 1.00 0.00 C ATOM 190 C THR A 13 12.394 -7.031 -3.981 1.00 0.00 C ATOM 191 O THR A 13 12.895 -7.860 -3.249 1.00 0.00 O ATOM 192 CB THR A 13 12.052 -8.836 -5.658 1.00 0.00 C ATOM 193 OG1 THR A 13 12.238 -9.645 -4.507 1.00 0.00 O ATOM 194 CG2 THR A 13 13.350 -8.776 -6.468 1.00 0.00 C ATOM 0 H THR A 13 12.197 -5.526 -5.986 1.00 0.00 H new ATOM 0 HA THR A 13 10.561 -7.437 -5.046 1.00 0.00 H new ATOM 0 HB THR A 13 11.268 -9.271 -6.278 1.00 0.00 H new ATOM 0 HG1 THR A 13 12.815 -9.177 -3.868 1.00 0.00 H new ATOM 0 HG21 THR A 13 13.642 -9.784 -6.763 1.00 0.00 H new ATOM 0 HG22 THR A 13 13.195 -8.168 -7.359 1.00 0.00 H new ATOM 0 HG23 THR A 13 14.139 -8.333 -5.859 1.00 0.00 H new ATOM 202 N GLY A 14 12.445 -5.763 -3.687 1.00 0.00 N ATOM 203 CA GLY A 14 13.126 -5.328 -2.438 1.00 0.00 C ATOM 204 C GLY A 14 12.117 -5.463 -1.296 1.00 0.00 C ATOM 205 O GLY A 14 12.256 -4.861 -0.249 1.00 0.00 O ATOM 0 H GLY A 14 12.047 -5.014 -4.253 1.00 0.00 H new ATOM 0 HA2 GLY A 14 14.006 -5.942 -2.247 1.00 0.00 H new ATOM 0 HA3 GLY A 14 13.469 -4.297 -2.527 1.00 0.00 H new ATOM 209 N ALA A 15 11.091 -6.249 -1.514 1.00 0.00 N ATOM 210 CA ALA A 15 10.033 -6.448 -0.491 1.00 0.00 C ATOM 211 C ALA A 15 8.783 -6.881 -1.243 1.00 0.00 C ATOM 212 O ALA A 15 7.940 -7.594 -0.735 1.00 0.00 O ATOM 213 CB ALA A 15 9.763 -5.137 0.254 1.00 0.00 C ATOM 0 H ALA A 15 10.945 -6.769 -2.379 1.00 0.00 H new ATOM 0 HA ALA A 15 10.334 -7.193 0.245 1.00 0.00 H new ATOM 0 HB1 ALA A 15 8.985 -5.297 1.001 1.00 0.00 H new ATOM 0 HB2 ALA A 15 10.676 -4.804 0.746 1.00 0.00 H new ATOM 0 HB3 ALA A 15 9.435 -4.377 -0.455 1.00 0.00 H new ATOM 219 N VAL A 16 8.680 -6.457 -2.475 1.00 0.00 N ATOM 220 CA VAL A 16 7.519 -6.834 -3.312 1.00 0.00 C ATOM 221 C VAL A 16 7.979 -6.839 -4.770 1.00 0.00 C ATOM 222 O VAL A 16 8.890 -6.123 -5.138 1.00 0.00 O ATOM 223 CB VAL A 16 6.400 -5.808 -3.119 1.00 0.00 C ATOM 224 CG1 VAL A 16 5.638 -6.122 -1.830 1.00 0.00 C ATOM 225 CG2 VAL A 16 7.007 -4.407 -3.014 1.00 0.00 C ATOM 0 H VAL A 16 9.364 -5.858 -2.937 1.00 0.00 H new ATOM 0 HA VAL A 16 7.141 -7.817 -3.032 1.00 0.00 H new ATOM 0 HB VAL A 16 5.718 -5.851 -3.969 1.00 0.00 H new ATOM 0 HG11 VAL A 16 4.841 -5.392 -1.692 1.00 0.00 H new ATOM 0 HG12 VAL A 16 5.207 -7.121 -1.896 1.00 0.00 H new ATOM 0 HG13 VAL A 16 6.322 -6.077 -0.983 1.00 0.00 H new ATOM 0 HG21 VAL A 16 6.211 -3.675 -2.877 1.00 0.00 H new ATOM 0 HG22 VAL A 16 7.687 -4.368 -2.163 1.00 0.00 H new ATOM 0 HG23 VAL A 16 7.556 -4.179 -3.928 1.00 0.00 H new ATOM 235 N THR A 17 7.370 -7.628 -5.609 1.00 0.00 N ATOM 236 CA THR A 17 7.798 -7.651 -7.038 1.00 0.00 C ATOM 237 C THR A 17 7.193 -6.447 -7.767 1.00 0.00 C ATOM 238 O THR A 17 7.285 -6.328 -8.973 1.00 0.00 O ATOM 239 CB THR A 17 7.320 -8.946 -7.698 1.00 0.00 C ATOM 240 OG1 THR A 17 6.634 -9.738 -6.738 1.00 0.00 O ATOM 241 CG2 THR A 17 8.525 -9.723 -8.233 1.00 0.00 C ATOM 0 H THR A 17 6.600 -8.254 -5.372 1.00 0.00 H new ATOM 0 HA THR A 17 8.885 -7.602 -7.093 1.00 0.00 H new ATOM 0 HB THR A 17 6.648 -8.708 -8.523 1.00 0.00 H new ATOM 0 HG1 THR A 17 6.466 -10.629 -7.109 1.00 0.00 H new ATOM 0 HG21 THR A 17 8.184 -10.645 -8.703 1.00 0.00 H new ATOM 0 HG22 THR A 17 9.053 -9.115 -8.968 1.00 0.00 H new ATOM 0 HG23 THR A 17 9.198 -9.963 -7.410 1.00 0.00 H new ATOM 249 N GLN A 18 6.581 -5.554 -7.035 1.00 0.00 N ATOM 250 CA GLN A 18 5.963 -4.347 -7.658 1.00 0.00 C ATOM 251 C GLN A 18 5.720 -3.303 -6.565 1.00 0.00 C ATOM 252 O GLN A 18 5.957 -3.552 -5.401 1.00 0.00 O ATOM 253 CB GLN A 18 4.621 -4.724 -8.297 1.00 0.00 C ATOM 254 CG GLN A 18 4.840 -5.762 -9.398 1.00 0.00 C ATOM 255 CD GLN A 18 3.517 -6.034 -10.117 1.00 0.00 C ATOM 256 OE1 GLN A 18 3.431 -5.905 -11.322 1.00 0.00 O ATOM 257 NE2 GLN A 18 2.476 -6.408 -9.425 1.00 0.00 N ATOM 0 H GLN A 18 6.482 -5.610 -6.021 1.00 0.00 H new ATOM 0 HA GLN A 18 6.627 -3.947 -8.424 1.00 0.00 H new ATOM 0 HB2 GLN A 18 3.947 -5.123 -7.539 1.00 0.00 H new ATOM 0 HB3 GLN A 18 4.144 -3.836 -8.712 1.00 0.00 H new ATOM 0 HG2 GLN A 18 5.584 -5.402 -10.108 1.00 0.00 H new ATOM 0 HG3 GLN A 18 5.229 -6.685 -8.969 1.00 0.00 H new ATOM 0 HE21 GLN A 18 2.548 -6.516 -8.413 1.00 0.00 H new ATOM 0 HE22 GLN A 18 1.590 -6.592 -9.896 1.00 0.00 H new ATOM 266 N ALA A 19 5.243 -2.138 -6.918 1.00 0.00 N ATOM 267 CA ALA A 19 4.990 -1.104 -5.872 1.00 0.00 C ATOM 268 C ALA A 19 4.385 0.151 -6.504 1.00 0.00 C ATOM 269 O ALA A 19 4.566 0.419 -7.675 1.00 0.00 O ATOM 270 CB ALA A 19 6.309 -0.738 -5.190 1.00 0.00 C ATOM 0 H ALA A 19 5.020 -1.860 -7.874 1.00 0.00 H new ATOM 0 HA ALA A 19 4.291 -1.507 -5.139 1.00 0.00 H new ATOM 0 HB1 ALA A 19 6.126 0.017 -4.426 1.00 0.00 H new ATOM 0 HB2 ALA A 19 6.738 -1.627 -4.727 1.00 0.00 H new ATOM 0 HB3 ALA A 19 7.004 -0.343 -5.931 1.00 0.00 H new ATOM 276 N ALA A 20 3.668 0.927 -5.733 1.00 0.00 N ATOM 277 CA ALA A 20 3.057 2.166 -6.287 1.00 0.00 C ATOM 278 C ALA A 20 2.969 3.230 -5.189 1.00 0.00 C ATOM 279 O ALA A 20 2.248 3.081 -4.223 1.00 0.00 O ATOM 280 CB ALA A 20 1.651 1.852 -6.803 1.00 0.00 C ATOM 0 H ALA A 20 3.481 0.754 -4.745 1.00 0.00 H new ATOM 0 HA ALA A 20 3.673 2.539 -7.105 1.00 0.00 H new ATOM 0 HB1 ALA A 20 1.202 2.758 -7.209 1.00 0.00 H new ATOM 0 HB2 ALA A 20 1.711 1.095 -7.585 1.00 0.00 H new ATOM 0 HB3 ALA A 20 1.037 1.479 -5.983 1.00 0.00 H new ATOM 286 N ILE A 21 3.686 4.311 -5.328 1.00 0.00 N ATOM 287 CA ILE A 21 3.619 5.378 -4.290 1.00 0.00 C ATOM 288 C ILE A 21 2.377 6.231 -4.544 1.00 0.00 C ATOM 289 O ILE A 21 2.269 6.901 -5.551 1.00 0.00 O ATOM 290 CB ILE A 21 4.869 6.259 -4.362 1.00 0.00 C ATOM 291 CG1 ILE A 21 6.107 5.379 -4.549 1.00 0.00 C ATOM 292 CG2 ILE A 21 5.006 7.058 -3.061 1.00 0.00 C ATOM 293 CD1 ILE A 21 6.385 4.611 -3.256 1.00 0.00 C ATOM 0 H ILE A 21 4.312 4.501 -6.111 1.00 0.00 H new ATOM 0 HA ILE A 21 3.566 4.924 -3.301 1.00 0.00 H new ATOM 0 HB ILE A 21 4.780 6.945 -5.205 1.00 0.00 H new ATOM 0 HG12 ILE A 21 5.950 4.682 -5.372 1.00 0.00 H new ATOM 0 HG13 ILE A 21 6.968 5.994 -4.812 1.00 0.00 H new ATOM 0 HG21 ILE A 21 5.896 7.686 -3.111 1.00 0.00 H new ATOM 0 HG22 ILE A 21 4.126 7.687 -2.926 1.00 0.00 H new ATOM 0 HG23 ILE A 21 5.094 6.371 -2.220 1.00 0.00 H new ATOM 0 HD11 ILE A 21 7.267 3.984 -3.388 1.00 0.00 H new ATOM 0 HD12 ILE A 21 6.560 5.317 -2.444 1.00 0.00 H new ATOM 0 HD13 ILE A 21 5.527 3.984 -3.013 1.00 0.00 H new ATOM 305 N LEU A 22 1.435 6.208 -3.643 1.00 0.00 N ATOM 306 CA LEU A 22 0.199 7.013 -3.843 1.00 0.00 C ATOM 307 C LEU A 22 0.209 8.192 -2.867 1.00 0.00 C ATOM 308 O LEU A 22 -0.296 8.105 -1.766 1.00 0.00 O ATOM 309 CB LEU A 22 -1.035 6.133 -3.595 1.00 0.00 C ATOM 310 CG LEU A 22 -0.704 4.669 -3.922 1.00 0.00 C ATOM 311 CD1 LEU A 22 -1.966 3.811 -3.813 1.00 0.00 C ATOM 312 CD2 LEU A 22 -0.158 4.571 -5.348 1.00 0.00 C ATOM 0 H LEU A 22 1.468 5.668 -2.779 1.00 0.00 H new ATOM 0 HA LEU A 22 0.162 7.389 -4.865 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -1.352 6.220 -2.556 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -1.866 6.474 -4.212 1.00 0.00 H new ATOM 0 HG LEU A 22 0.043 4.310 -3.214 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -1.723 2.774 -4.046 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -2.361 3.872 -2.799 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -2.715 4.175 -4.516 1.00 0.00 H new ATOM 0 HD21 LEU A 22 0.076 3.531 -5.577 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -0.907 4.938 -6.050 1.00 0.00 H new ATOM 0 HD23 LEU A 22 0.746 5.174 -5.434 1.00 0.00 H new ATOM 324 N GLY A 23 0.792 9.292 -3.262 1.00 0.00 N ATOM 325 CA GLY A 23 0.850 10.477 -2.359 1.00 0.00 C ATOM 326 C GLY A 23 -0.540 10.785 -1.803 1.00 0.00 C ATOM 327 O GLY A 23 -1.498 10.085 -2.067 1.00 0.00 O ATOM 0 H GLY A 23 1.232 9.421 -4.173 1.00 0.00 H new ATOM 0 HA2 GLY A 23 1.543 10.286 -1.540 1.00 0.00 H new ATOM 0 HA3 GLY A 23 1.231 11.341 -2.904 1.00 0.00 H new ATOM 331 N LEU A 24 -0.655 11.832 -1.032 1.00 0.00 N ATOM 332 CA LEU A 24 -1.977 12.199 -0.451 1.00 0.00 C ATOM 333 C LEU A 24 -2.769 13.021 -1.469 1.00 0.00 C ATOM 334 O LEU A 24 -3.910 12.725 -1.767 1.00 0.00 O ATOM 335 CB LEU A 24 -1.761 13.027 0.817 1.00 0.00 C ATOM 336 CG LEU A 24 -0.609 12.430 1.628 1.00 0.00 C ATOM 337 CD1 LEU A 24 -0.353 13.288 2.868 1.00 0.00 C ATOM 338 CD2 LEU A 24 -0.973 11.008 2.064 1.00 0.00 C ATOM 0 H LEU A 24 0.114 12.452 -0.779 1.00 0.00 H new ATOM 0 HA LEU A 24 -2.532 11.294 -0.205 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -1.537 14.061 0.555 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -2.672 13.040 1.415 1.00 0.00 H new ATOM 0 HG LEU A 24 0.289 12.405 1.011 1.00 0.00 H new ATOM 0 HD11 LEU A 24 0.468 12.860 3.443 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -0.092 14.301 2.562 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -1.252 13.315 3.484 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -0.152 10.583 2.642 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -1.873 11.035 2.678 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -1.153 10.392 1.183 1.00 0.00 H new ATOM 350 N ASP A 25 -2.171 14.047 -2.009 1.00 0.00 N ATOM 351 CA ASP A 25 -2.886 14.882 -3.013 1.00 0.00 C ATOM 352 C ASP A 25 -2.454 14.454 -4.415 1.00 0.00 C ATOM 353 O ASP A 25 -2.711 15.129 -5.392 1.00 0.00 O ATOM 354 CB ASP A 25 -2.536 16.356 -2.795 1.00 0.00 C ATOM 355 CG ASP A 25 -3.822 17.175 -2.651 1.00 0.00 C ATOM 356 OD1 ASP A 25 -4.884 16.618 -2.870 1.00 0.00 O ATOM 357 OD2 ASP A 25 -3.720 18.345 -2.324 1.00 0.00 O ATOM 0 H ASP A 25 -1.218 14.343 -1.798 1.00 0.00 H new ATOM 0 HA ASP A 25 -3.962 14.749 -2.904 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -1.921 16.466 -1.902 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -1.948 16.728 -3.634 1.00 0.00 H new ATOM 362 N GLY A 26 -1.799 13.329 -4.519 1.00 0.00 N ATOM 363 CA GLY A 26 -1.345 12.845 -5.852 1.00 0.00 C ATOM 364 C GLY A 26 -1.756 11.381 -6.024 1.00 0.00 C ATOM 365 O GLY A 26 -0.965 10.481 -5.828 1.00 0.00 O ATOM 0 H GLY A 26 -1.559 12.723 -3.734 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -1.785 13.454 -6.642 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -0.263 12.944 -5.939 1.00 0.00 H new ATOM 369 N ASN A 27 -2.993 11.149 -6.373 1.00 0.00 N ATOM 370 CA ASN A 27 -3.490 9.745 -6.553 1.00 0.00 C ATOM 371 C ASN A 27 -2.387 8.858 -7.139 1.00 0.00 C ATOM 372 O ASN A 27 -2.329 7.675 -6.870 1.00 0.00 O ATOM 373 CB ASN A 27 -4.707 9.714 -7.496 1.00 0.00 C ATOM 374 CG ASN A 27 -4.901 11.070 -8.185 1.00 0.00 C ATOM 375 OD1 ASN A 27 -5.403 12.002 -7.587 1.00 0.00 O ATOM 376 ND2 ASN A 27 -4.523 11.219 -9.424 1.00 0.00 N ATOM 0 H ASN A 27 -3.689 11.875 -6.543 1.00 0.00 H new ATOM 0 HA ASN A 27 -3.782 9.368 -5.573 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -4.570 8.936 -8.247 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -5.603 9.457 -6.931 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -4.648 12.117 -9.891 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -4.102 10.437 -9.926 1.00 0.00 H new ATOM 383 N THR A 28 -1.512 9.409 -7.938 1.00 0.00 N ATOM 384 CA THR A 28 -0.426 8.572 -8.529 1.00 0.00 C ATOM 385 C THR A 28 0.898 9.341 -8.519 1.00 0.00 C ATOM 386 O THR A 28 1.160 10.156 -9.381 1.00 0.00 O ATOM 387 CB THR A 28 -0.788 8.202 -9.970 1.00 0.00 C ATOM 388 OG1 THR A 28 -2.201 8.178 -10.110 1.00 0.00 O ATOM 389 CG2 THR A 28 -0.215 6.822 -10.302 1.00 0.00 C ATOM 0 H THR A 28 -1.501 10.393 -8.205 1.00 0.00 H new ATOM 0 HA THR A 28 -0.317 7.665 -7.934 1.00 0.00 H new ATOM 0 HB THR A 28 -0.369 8.941 -10.653 1.00 0.00 H new ATOM 0 HG1 THR A 28 -2.434 7.943 -11.032 1.00 0.00 H new ATOM 0 HG21 THR A 28 -0.473 6.558 -11.328 1.00 0.00 H new ATOM 0 HG22 THR A 28 0.869 6.843 -10.194 1.00 0.00 H new ATOM 0 HG23 THR A 28 -0.633 6.081 -9.621 1.00 0.00 H new ATOM 397 N TRP A 29 1.742 9.076 -7.557 1.00 0.00 N ATOM 398 CA TRP A 29 3.056 9.779 -7.498 1.00 0.00 C ATOM 399 C TRP A 29 4.120 8.902 -8.160 1.00 0.00 C ATOM 400 O TRP A 29 5.131 9.381 -8.632 1.00 0.00 O ATOM 401 CB TRP A 29 3.443 10.022 -6.035 1.00 0.00 C ATOM 402 CG TRP A 29 2.924 11.350 -5.576 1.00 0.00 C ATOM 403 CD1 TRP A 29 2.270 12.249 -6.351 1.00 0.00 C ATOM 404 CD2 TRP A 29 3.010 11.943 -4.248 1.00 0.00 C ATOM 405 NE1 TRP A 29 1.952 13.354 -5.582 1.00 0.00 N ATOM 406 CE2 TRP A 29 2.386 13.214 -4.279 1.00 0.00 C ATOM 407 CE3 TRP A 29 3.563 11.507 -3.030 1.00 0.00 C ATOM 408 CZ2 TRP A 29 2.314 14.021 -3.142 1.00 0.00 C ATOM 409 CZ3 TRP A 29 3.491 12.317 -1.884 1.00 0.00 C ATOM 410 CH2 TRP A 29 2.868 13.572 -1.941 1.00 0.00 C ATOM 0 H TRP A 29 1.577 8.402 -6.809 1.00 0.00 H new ATOM 0 HA TRP A 29 2.984 10.734 -8.018 1.00 0.00 H new ATOM 0 HB2 TRP A 29 3.038 9.228 -5.407 1.00 0.00 H new ATOM 0 HB3 TRP A 29 4.527 9.990 -5.928 1.00 0.00 H new ATOM 0 HD1 TRP A 29 2.035 12.123 -7.398 1.00 0.00 H new ATOM 0 HE1 TRP A 29 1.457 14.173 -5.935 1.00 0.00 H new ATOM 0 HE3 TRP A 29 4.046 10.543 -2.975 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 1.833 14.987 -3.191 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 3.918 11.971 -0.954 1.00 0.00 H new ATOM 0 HH2 TRP A 29 2.817 14.191 -1.057 1.00 0.00 H new ATOM 421 N ALA A 30 3.896 7.618 -8.193 1.00 0.00 N ATOM 422 CA ALA A 30 4.886 6.698 -8.820 1.00 0.00 C ATOM 423 C ALA A 30 4.278 5.297 -8.900 1.00 0.00 C ATOM 424 O ALA A 30 3.532 4.886 -8.034 1.00 0.00 O ATOM 425 CB ALA A 30 6.158 6.657 -7.970 1.00 0.00 C ATOM 0 H ALA A 30 3.066 7.164 -7.811 1.00 0.00 H new ATOM 0 HA ALA A 30 5.136 7.050 -9.821 1.00 0.00 H new ATOM 0 HB1 ALA A 30 6.881 5.984 -8.430 1.00 0.00 H new ATOM 0 HB2 ALA A 30 6.584 7.658 -7.905 1.00 0.00 H new ATOM 0 HB3 ALA A 30 5.915 6.300 -6.969 1.00 0.00 H new ATOM 431 N THR A 31 4.582 4.561 -9.933 1.00 0.00 N ATOM 432 CA THR A 31 4.010 3.192 -10.056 1.00 0.00 C ATOM 433 C THR A 31 4.982 2.290 -10.814 1.00 0.00 C ATOM 434 O THR A 31 5.875 2.754 -11.497 1.00 0.00 O ATOM 435 CB THR A 31 2.683 3.263 -10.818 1.00 0.00 C ATOM 436 OG1 THR A 31 2.855 4.055 -11.986 1.00 0.00 O ATOM 437 CG2 THR A 31 1.609 3.891 -9.926 1.00 0.00 C ATOM 0 H THR A 31 5.199 4.847 -10.694 1.00 0.00 H new ATOM 0 HA THR A 31 3.841 2.782 -9.060 1.00 0.00 H new ATOM 0 HB THR A 31 2.371 2.257 -11.100 1.00 0.00 H new ATOM 0 HG1 THR A 31 2.008 4.101 -12.477 1.00 0.00 H new ATOM 0 HG21 THR A 31 0.666 3.940 -10.471 1.00 0.00 H new ATOM 0 HG22 THR A 31 1.479 3.284 -9.030 1.00 0.00 H new ATOM 0 HG23 THR A 31 1.916 4.897 -9.641 1.00 0.00 H new ATOM 445 N SER A 32 4.812 1.003 -10.700 1.00 0.00 N ATOM 446 CA SER A 32 5.718 0.062 -11.411 1.00 0.00 C ATOM 447 C SER A 32 5.103 -1.338 -11.394 1.00 0.00 C ATOM 448 O SER A 32 5.409 -2.153 -10.545 1.00 0.00 O ATOM 449 CB SER A 32 7.076 0.034 -10.710 1.00 0.00 C ATOM 450 OG SER A 32 6.988 0.754 -9.488 1.00 0.00 O ATOM 0 H SER A 32 4.081 0.561 -10.142 1.00 0.00 H new ATOM 0 HA SER A 32 5.852 0.390 -12.442 1.00 0.00 H new ATOM 0 HB2 SER A 32 7.378 -0.996 -10.518 1.00 0.00 H new ATOM 0 HB3 SER A 32 7.839 0.475 -11.352 1.00 0.00 H new ATOM 0 HG SER A 32 6.447 0.246 -8.847 1.00 0.00 H new ATOM 456 N ALA A 33 4.233 -1.622 -12.324 1.00 0.00 N ATOM 457 CA ALA A 33 3.593 -2.966 -12.364 1.00 0.00 C ATOM 458 C ALA A 33 2.771 -3.096 -13.646 1.00 0.00 C ATOM 459 O ALA A 33 3.093 -3.868 -14.527 1.00 0.00 O ATOM 460 CB ALA A 33 2.674 -3.131 -11.154 1.00 0.00 C ATOM 0 H ALA A 33 3.938 -0.980 -13.059 1.00 0.00 H new ATOM 0 HA ALA A 33 4.363 -3.737 -12.342 1.00 0.00 H new ATOM 0 HB1 ALA A 33 2.206 -4.115 -11.184 1.00 0.00 H new ATOM 0 HB2 ALA A 33 3.257 -3.034 -10.238 1.00 0.00 H new ATOM 0 HB3 ALA A 33 1.902 -2.361 -11.176 1.00 0.00 H new ATOM 466 N GLY A 34 1.712 -2.341 -13.758 1.00 0.00 N ATOM 467 CA GLY A 34 0.869 -2.417 -14.984 1.00 0.00 C ATOM 468 C GLY A 34 -0.610 -2.371 -14.599 1.00 0.00 C ATOM 469 O GLY A 34 -1.454 -2.007 -15.393 1.00 0.00 O ATOM 0 H GLY A 34 1.395 -1.675 -13.053 1.00 0.00 H new ATOM 0 HA2 GLY A 34 1.106 -1.589 -15.652 1.00 0.00 H new ATOM 0 HA3 GLY A 34 1.084 -3.337 -15.528 1.00 0.00 H new ATOM 473 N PHE A 35 -0.937 -2.740 -13.390 1.00 0.00 N ATOM 474 CA PHE A 35 -2.368 -2.714 -12.975 1.00 0.00 C ATOM 475 C PHE A 35 -2.899 -1.279 -13.035 1.00 0.00 C ATOM 476 O PHE A 35 -2.185 -0.357 -13.375 1.00 0.00 O ATOM 477 CB PHE A 35 -2.516 -3.279 -11.556 1.00 0.00 C ATOM 478 CG PHE A 35 -1.831 -2.396 -10.530 1.00 0.00 C ATOM 479 CD1 PHE A 35 -1.005 -1.331 -10.924 1.00 0.00 C ATOM 480 CD2 PHE A 35 -2.029 -2.655 -9.168 1.00 0.00 C ATOM 481 CE1 PHE A 35 -0.383 -0.533 -9.954 1.00 0.00 C ATOM 482 CE2 PHE A 35 -1.407 -1.857 -8.202 1.00 0.00 C ATOM 483 CZ PHE A 35 -0.585 -0.797 -8.594 1.00 0.00 C ATOM 0 H PHE A 35 -0.280 -3.056 -12.677 1.00 0.00 H new ATOM 0 HA PHE A 35 -2.949 -3.334 -13.657 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -3.574 -3.372 -11.309 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -2.090 -4.282 -11.517 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -0.849 -1.127 -11.973 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -2.664 -3.473 -8.862 1.00 0.00 H new ATOM 0 HE1 PHE A 35 0.253 0.286 -10.256 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -1.562 -2.060 -7.153 1.00 0.00 H new ATOM 0 HZ PHE A 35 -0.105 -0.181 -7.848 1.00 0.00 H new ATOM 493 N ALA A 36 -4.151 -1.085 -12.725 1.00 0.00 N ATOM 494 CA ALA A 36 -4.727 0.290 -12.781 1.00 0.00 C ATOM 495 C ALA A 36 -4.966 0.817 -11.362 1.00 0.00 C ATOM 496 O ALA A 36 -5.629 0.192 -10.559 1.00 0.00 O ATOM 497 CB ALA A 36 -6.054 0.255 -13.545 1.00 0.00 C ATOM 0 H ALA A 36 -4.800 -1.817 -12.436 1.00 0.00 H new ATOM 0 HA ALA A 36 -4.027 0.951 -13.292 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -6.476 1.259 -13.587 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -5.881 -0.108 -14.558 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -6.750 -0.410 -13.035 1.00 0.00 H new ATOM 503 N VAL A 37 -4.431 1.969 -11.056 1.00 0.00 N ATOM 504 CA VAL A 37 -4.621 2.557 -9.698 1.00 0.00 C ATOM 505 C VAL A 37 -4.718 4.080 -9.833 1.00 0.00 C ATOM 506 O VAL A 37 -3.728 4.759 -10.019 1.00 0.00 O ATOM 507 CB VAL A 37 -3.425 2.168 -8.808 1.00 0.00 C ATOM 508 CG1 VAL A 37 -3.298 3.115 -7.605 1.00 0.00 C ATOM 509 CG2 VAL A 37 -3.625 0.743 -8.291 1.00 0.00 C ATOM 0 H VAL A 37 -3.867 2.532 -11.693 1.00 0.00 H new ATOM 0 HA VAL A 37 -5.535 2.179 -9.240 1.00 0.00 H new ATOM 0 HB VAL A 37 -2.517 2.237 -9.407 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -2.446 2.816 -6.995 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -3.151 4.135 -7.959 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -4.207 3.066 -7.006 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -2.781 0.463 -7.661 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -4.545 0.693 -7.709 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -3.691 0.056 -9.135 1.00 0.00 H new ATOM 519 N THR A 38 -5.905 4.624 -9.739 1.00 0.00 N ATOM 520 CA THR A 38 -6.060 6.106 -9.858 1.00 0.00 C ATOM 521 C THR A 38 -7.515 6.514 -9.557 1.00 0.00 C ATOM 522 O THR A 38 -7.751 7.285 -8.650 1.00 0.00 O ATOM 523 CB THR A 38 -5.650 6.598 -11.265 1.00 0.00 C ATOM 524 OG1 THR A 38 -6.703 7.367 -11.827 1.00 0.00 O ATOM 525 CG2 THR A 38 -5.329 5.417 -12.190 1.00 0.00 C ATOM 0 H THR A 38 -6.771 4.108 -9.585 1.00 0.00 H new ATOM 0 HA THR A 38 -5.399 6.575 -9.129 1.00 0.00 H new ATOM 0 HB THR A 38 -4.755 7.212 -11.166 1.00 0.00 H new ATOM 0 HG1 THR A 38 -6.440 7.679 -12.718 1.00 0.00 H new ATOM 0 HG21 THR A 38 -5.044 5.792 -13.173 1.00 0.00 H new ATOM 0 HG22 THR A 38 -4.506 4.839 -11.769 1.00 0.00 H new ATOM 0 HG23 THR A 38 -6.209 4.780 -12.286 1.00 0.00 H new ATOM 533 N PRO A 39 -8.451 5.993 -10.320 1.00 0.00 N ATOM 534 CA PRO A 39 -9.880 6.313 -10.124 1.00 0.00 C ATOM 535 C PRO A 39 -10.338 5.917 -8.714 1.00 0.00 C ATOM 536 O PRO A 39 -10.309 4.760 -8.344 1.00 0.00 O ATOM 537 CB PRO A 39 -10.619 5.483 -11.181 1.00 0.00 C ATOM 538 CG PRO A 39 -9.562 4.653 -11.951 1.00 0.00 C ATOM 539 CD PRO A 39 -8.176 5.058 -11.427 1.00 0.00 C ATOM 0 HA PRO A 39 -10.076 7.380 -10.226 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -11.351 4.827 -10.709 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -11.166 6.133 -11.864 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -9.730 3.587 -11.802 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -9.635 4.840 -13.022 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -7.614 4.190 -11.082 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -7.581 5.533 -12.207 1.00 0.00 H new ATOM 547 N ALA A 40 -10.770 6.869 -7.931 1.00 0.00 N ATOM 548 CA ALA A 40 -11.242 6.551 -6.550 1.00 0.00 C ATOM 549 C ALA A 40 -10.151 5.799 -5.785 1.00 0.00 C ATOM 550 O ALA A 40 -10.432 4.928 -4.988 1.00 0.00 O ATOM 551 CB ALA A 40 -12.494 5.677 -6.627 1.00 0.00 C ATOM 0 H ALA A 40 -10.817 7.855 -8.188 1.00 0.00 H new ATOM 0 HA ALA A 40 -11.472 7.481 -6.030 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -12.838 5.445 -5.619 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -13.278 6.211 -7.164 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -12.260 4.751 -7.152 1.00 0.00 H new ATOM 557 N GLN A 41 -8.911 6.123 -6.020 1.00 0.00 N ATOM 558 CA GLN A 41 -7.814 5.416 -5.302 1.00 0.00 C ATOM 559 C GLN A 41 -7.482 6.157 -4.003 1.00 0.00 C ATOM 560 O GLN A 41 -7.479 5.579 -2.933 1.00 0.00 O ATOM 561 CB GLN A 41 -6.577 5.362 -6.199 1.00 0.00 C ATOM 562 CG GLN A 41 -6.394 3.935 -6.725 1.00 0.00 C ATOM 563 CD GLN A 41 -5.678 3.089 -5.670 1.00 0.00 C ATOM 564 OE1 GLN A 41 -5.313 3.582 -4.622 1.00 0.00 O ATOM 565 NE2 GLN A 41 -5.461 1.823 -5.905 1.00 0.00 N ATOM 0 H GLN A 41 -8.610 6.844 -6.676 1.00 0.00 H new ATOM 0 HA GLN A 41 -8.132 4.402 -5.060 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -6.687 6.057 -7.031 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -5.694 5.671 -5.639 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -7.363 3.496 -6.961 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -5.816 3.948 -7.649 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -5.767 1.408 -6.785 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -4.985 1.249 -5.209 1.00 0.00 H new ATOM 574 N GLY A 42 -7.200 7.429 -4.086 1.00 0.00 N ATOM 575 CA GLY A 42 -6.865 8.201 -2.854 1.00 0.00 C ATOM 576 C GLY A 42 -8.146 8.527 -2.081 1.00 0.00 C ATOM 577 O GLY A 42 -8.194 8.422 -0.871 1.00 0.00 O ATOM 0 H GLY A 42 -7.187 7.967 -4.952 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -6.187 7.624 -2.225 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.346 9.122 -3.121 1.00 0.00 H new ATOM 581 N GLN A 43 -9.183 8.927 -2.767 1.00 0.00 N ATOM 582 CA GLN A 43 -10.455 9.262 -2.064 1.00 0.00 C ATOM 583 C GLN A 43 -10.962 8.034 -1.302 1.00 0.00 C ATOM 584 O GLN A 43 -11.655 8.149 -0.311 1.00 0.00 O ATOM 585 CB GLN A 43 -11.508 9.697 -3.085 1.00 0.00 C ATOM 586 CG GLN A 43 -11.949 8.490 -3.914 1.00 0.00 C ATOM 587 CD GLN A 43 -13.222 7.891 -3.312 1.00 0.00 C ATOM 588 OE1 GLN A 43 -14.061 8.606 -2.802 1.00 0.00 O ATOM 589 NE2 GLN A 43 -13.403 6.599 -3.353 1.00 0.00 N ATOM 0 H GLN A 43 -9.204 9.036 -3.781 1.00 0.00 H new ATOM 0 HA GLN A 43 -10.273 10.075 -1.361 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -12.366 10.133 -2.574 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -11.100 10.469 -3.737 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -12.130 8.791 -4.946 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -11.157 7.741 -3.934 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -12.698 5.999 -3.781 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -14.249 6.190 -2.957 1.00 0.00 H new ATOM 598 N THR A 44 -10.622 6.859 -1.757 1.00 0.00 N ATOM 599 CA THR A 44 -11.084 5.627 -1.056 1.00 0.00 C ATOM 600 C THR A 44 -10.412 5.542 0.314 1.00 0.00 C ATOM 601 O THR A 44 -11.066 5.410 1.330 1.00 0.00 O ATOM 602 CB THR A 44 -10.710 4.397 -1.890 1.00 0.00 C ATOM 603 OG1 THR A 44 -11.551 4.327 -3.032 1.00 0.00 O ATOM 604 CG2 THR A 44 -10.885 3.132 -1.047 1.00 0.00 C ATOM 0 H THR A 44 -10.045 6.699 -2.583 1.00 0.00 H new ATOM 0 HA THR A 44 -12.166 5.662 -0.928 1.00 0.00 H new ATOM 0 HB THR A 44 -9.671 4.477 -2.208 1.00 0.00 H new ATOM 0 HG1 THR A 44 -11.001 4.238 -3.838 1.00 0.00 H new ATOM 0 HG21 THR A 44 -10.619 2.258 -1.642 1.00 0.00 H new ATOM 0 HG22 THR A 44 -10.238 3.186 -0.171 1.00 0.00 H new ATOM 0 HG23 THR A 44 -11.923 3.049 -0.726 1.00 0.00 H new ATOM 612 N LEU A 45 -9.110 5.617 0.352 1.00 0.00 N ATOM 613 CA LEU A 45 -8.394 5.540 1.658 1.00 0.00 C ATOM 614 C LEU A 45 -8.786 6.734 2.532 1.00 0.00 C ATOM 615 O LEU A 45 -8.796 6.653 3.744 1.00 0.00 O ATOM 616 CB LEU A 45 -6.883 5.558 1.411 1.00 0.00 C ATOM 617 CG LEU A 45 -6.364 4.122 1.325 1.00 0.00 C ATOM 618 CD1 LEU A 45 -6.982 3.427 0.110 1.00 0.00 C ATOM 619 CD2 LEU A 45 -4.840 4.137 1.180 1.00 0.00 C ATOM 0 H LEU A 45 -8.510 5.728 -0.465 1.00 0.00 H new ATOM 0 HA LEU A 45 -8.668 4.617 2.168 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -6.661 6.092 0.487 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -6.378 6.091 2.217 1.00 0.00 H new ATOM 0 HG LEU A 45 -6.639 3.583 2.232 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -6.612 2.404 0.049 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -8.067 3.415 0.211 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -6.708 3.967 -0.796 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -4.470 3.113 1.119 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -4.566 4.677 0.273 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -4.397 4.632 2.044 1.00 0.00 H new ATOM 631 N ALA A 46 -9.111 7.844 1.926 1.00 0.00 N ATOM 632 CA ALA A 46 -9.504 9.042 2.721 1.00 0.00 C ATOM 633 C ALA A 46 -10.770 8.732 3.521 1.00 0.00 C ATOM 634 O ALA A 46 -10.914 9.138 4.656 1.00 0.00 O ATOM 635 CB ALA A 46 -9.773 10.213 1.776 1.00 0.00 C ATOM 0 H ALA A 46 -9.121 7.973 0.914 1.00 0.00 H new ATOM 0 HA ALA A 46 -8.697 9.304 3.406 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -10.061 11.090 2.356 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -8.871 10.435 1.206 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -10.580 9.950 1.091 1.00 0.00 H new ATOM 641 N SER A 47 -11.691 8.015 2.936 1.00 0.00 N ATOM 642 CA SER A 47 -12.949 7.681 3.662 1.00 0.00 C ATOM 643 C SER A 47 -12.738 6.412 4.493 1.00 0.00 C ATOM 644 O SER A 47 -13.496 6.116 5.395 1.00 0.00 O ATOM 645 CB SER A 47 -14.075 7.452 2.653 1.00 0.00 C ATOM 646 OG SER A 47 -15.109 6.696 3.266 1.00 0.00 O ATOM 0 H SER A 47 -11.626 7.646 1.987 1.00 0.00 H new ATOM 0 HA SER A 47 -13.217 8.505 4.323 1.00 0.00 H new ATOM 0 HB2 SER A 47 -14.466 8.408 2.304 1.00 0.00 H new ATOM 0 HB3 SER A 47 -13.693 6.925 1.778 1.00 0.00 H new ATOM 0 HG SER A 47 -15.833 6.549 2.622 1.00 0.00 H new ATOM 652 N ALA A 48 -11.714 5.660 4.196 1.00 0.00 N ATOM 653 CA ALA A 48 -11.459 4.413 4.971 1.00 0.00 C ATOM 654 C ALA A 48 -10.810 4.770 6.311 1.00 0.00 C ATOM 655 O ALA A 48 -10.841 4.002 7.252 1.00 0.00 O ATOM 656 CB ALA A 48 -10.520 3.505 4.173 1.00 0.00 C ATOM 0 H ALA A 48 -11.044 5.855 3.452 1.00 0.00 H new ATOM 0 HA ALA A 48 -12.401 3.895 5.152 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -10.331 2.592 4.737 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -10.982 3.253 3.218 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -9.578 4.023 3.995 1.00 0.00 H new ATOM 662 N PHE A 49 -10.219 5.931 6.405 1.00 0.00 N ATOM 663 CA PHE A 49 -9.566 6.334 7.684 1.00 0.00 C ATOM 664 C PHE A 49 -10.628 6.816 8.674 1.00 0.00 C ATOM 665 O PHE A 49 -10.356 7.021 9.841 1.00 0.00 O ATOM 666 CB PHE A 49 -8.574 7.469 7.415 1.00 0.00 C ATOM 667 CG PHE A 49 -7.386 6.933 6.655 1.00 0.00 C ATOM 668 CD1 PHE A 49 -6.649 5.862 7.172 1.00 0.00 C ATOM 669 CD2 PHE A 49 -7.022 7.508 5.431 1.00 0.00 C ATOM 670 CE1 PHE A 49 -5.547 5.366 6.466 1.00 0.00 C ATOM 671 CE2 PHE A 49 -5.921 7.012 4.725 1.00 0.00 C ATOM 672 CZ PHE A 49 -5.183 5.940 5.243 1.00 0.00 C ATOM 0 H PHE A 49 -10.160 6.617 5.652 1.00 0.00 H new ATOM 0 HA PHE A 49 -9.039 5.478 8.104 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -9.058 8.260 6.843 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -8.247 7.911 8.356 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -6.930 5.418 8.116 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -7.591 8.334 5.032 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -4.977 4.540 6.865 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -5.640 7.455 3.781 1.00 0.00 H new ATOM 0 HZ PHE A 49 -4.333 5.556 4.698 1.00 0.00 H new ATOM 682 N ASN A 50 -11.836 7.002 8.220 1.00 0.00 N ATOM 683 CA ASN A 50 -12.909 7.473 9.139 1.00 0.00 C ATOM 684 C ASN A 50 -13.597 6.269 9.783 1.00 0.00 C ATOM 685 O ASN A 50 -14.505 6.415 10.579 1.00 0.00 O ATOM 686 CB ASN A 50 -13.937 8.288 8.348 1.00 0.00 C ATOM 687 CG ASN A 50 -14.752 9.157 9.308 1.00 0.00 C ATOM 688 OD1 ASN A 50 -15.486 8.650 10.133 1.00 0.00 O ATOM 689 ND2 ASN A 50 -14.654 10.456 9.234 1.00 0.00 N ATOM 0 H ASN A 50 -12.126 6.849 7.254 1.00 0.00 H new ATOM 0 HA ASN A 50 -12.471 8.098 9.917 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -13.432 8.915 7.614 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -14.598 7.620 7.796 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -15.193 11.045 9.868 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -14.038 10.882 8.542 1.00 0.00 H new ATOM 696 N ASN A 51 -13.178 5.077 9.449 1.00 0.00 N ATOM 697 CA ASN A 51 -13.818 3.871 10.047 1.00 0.00 C ATOM 698 C ASN A 51 -13.235 2.605 9.413 1.00 0.00 C ATOM 699 O ASN A 51 -13.350 2.386 8.223 1.00 0.00 O ATOM 700 CB ASN A 51 -15.327 3.919 9.795 1.00 0.00 C ATOM 701 CG ASN A 51 -15.597 4.539 8.423 1.00 0.00 C ATOM 702 OD1 ASN A 51 -15.180 4.010 7.412 1.00 0.00 O ATOM 703 ND2 ASN A 51 -16.283 5.647 8.343 1.00 0.00 N ATOM 0 H ASN A 51 -12.423 4.888 8.790 1.00 0.00 H new ATOM 0 HA ASN A 51 -13.626 3.856 11.120 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -15.746 2.914 9.840 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -15.818 4.504 10.573 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -16.468 6.067 7.432 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -16.634 6.092 9.191 1.00 0.00 H new ATOM 710 N ALA A 52 -12.618 1.768 10.202 1.00 0.00 N ATOM 711 CA ALA A 52 -12.034 0.513 9.649 1.00 0.00 C ATOM 712 C ALA A 52 -13.038 -0.629 9.820 1.00 0.00 C ATOM 713 O ALA A 52 -12.897 -1.687 9.241 1.00 0.00 O ATOM 714 CB ALA A 52 -10.744 0.172 10.401 1.00 0.00 C ATOM 0 H ALA A 52 -12.493 1.899 11.206 1.00 0.00 H new ATOM 0 HA ALA A 52 -11.811 0.651 8.591 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -10.318 -0.746 9.996 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -10.029 0.986 10.284 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -10.966 0.033 11.459 1.00 0.00 H new ATOM 720 N ASP A 53 -14.052 -0.422 10.613 1.00 0.00 N ATOM 721 CA ASP A 53 -15.068 -1.490 10.824 1.00 0.00 C ATOM 722 C ASP A 53 -15.783 -1.809 9.505 1.00 0.00 C ATOM 723 O ASP A 53 -15.899 -2.960 9.134 1.00 0.00 O ATOM 724 CB ASP A 53 -16.095 -1.019 11.855 1.00 0.00 C ATOM 725 CG ASP A 53 -15.799 -1.673 13.205 1.00 0.00 C ATOM 726 OD1 ASP A 53 -16.026 -2.866 13.325 1.00 0.00 O ATOM 727 OD2 ASP A 53 -15.350 -0.972 14.097 1.00 0.00 O ATOM 0 H ASP A 53 -14.221 0.444 11.125 1.00 0.00 H new ATOM 0 HA ASP A 53 -14.567 -2.389 11.184 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -16.060 0.066 11.949 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -17.101 -1.278 11.526 1.00 0.00 H new ATOM 732 N PRO A 54 -16.257 -0.783 8.839 1.00 0.00 N ATOM 733 CA PRO A 54 -16.981 -0.945 7.565 1.00 0.00 C ATOM 734 C PRO A 54 -16.066 -1.536 6.485 1.00 0.00 C ATOM 735 O PRO A 54 -16.524 -1.968 5.446 1.00 0.00 O ATOM 736 CB PRO A 54 -17.419 0.473 7.177 1.00 0.00 C ATOM 737 CG PRO A 54 -16.898 1.443 8.268 1.00 0.00 C ATOM 738 CD PRO A 54 -16.121 0.612 9.300 1.00 0.00 C ATOM 0 HA PRO A 54 -17.825 -1.628 7.663 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -17.017 0.744 6.201 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -18.505 0.530 7.101 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -16.254 2.204 7.827 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -17.728 1.965 8.744 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -15.075 0.914 9.344 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -16.532 0.740 10.301 1.00 0.00 H new ATOM 746 N ILE A 55 -14.780 -1.557 6.710 1.00 0.00 N ATOM 747 CA ILE A 55 -13.863 -2.120 5.676 1.00 0.00 C ATOM 748 C ILE A 55 -13.641 -3.614 5.946 1.00 0.00 C ATOM 749 O ILE A 55 -13.152 -4.339 5.102 1.00 0.00 O ATOM 750 CB ILE A 55 -12.519 -1.357 5.685 1.00 0.00 C ATOM 751 CG1 ILE A 55 -11.472 -2.095 6.528 1.00 0.00 C ATOM 752 CG2 ILE A 55 -12.720 0.042 6.268 1.00 0.00 C ATOM 753 CD1 ILE A 55 -10.179 -1.280 6.554 1.00 0.00 C ATOM 0 H ILE A 55 -14.327 -1.212 7.557 1.00 0.00 H new ATOM 0 HA ILE A 55 -14.314 -2.004 4.690 1.00 0.00 H new ATOM 0 HB ILE A 55 -12.165 -1.290 4.656 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -11.843 -2.242 7.542 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -11.284 -3.084 6.111 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -11.769 0.575 6.272 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -13.440 0.589 5.660 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -13.094 -0.039 7.289 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -9.432 -1.802 7.153 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -9.807 -1.156 5.537 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -10.375 -0.301 6.991 1.00 0.00 H new ATOM 765 N ARG A 56 -13.993 -4.075 7.114 1.00 0.00 N ATOM 766 CA ARG A 56 -13.799 -5.517 7.434 1.00 0.00 C ATOM 767 C ARG A 56 -14.950 -6.331 6.839 1.00 0.00 C ATOM 768 O ARG A 56 -14.742 -7.338 6.191 1.00 0.00 O ATOM 769 CB ARG A 56 -13.776 -5.709 8.952 1.00 0.00 C ATOM 770 CG ARG A 56 -12.981 -4.573 9.602 1.00 0.00 C ATOM 771 CD ARG A 56 -12.098 -5.120 10.731 1.00 0.00 C ATOM 772 NE ARG A 56 -12.649 -6.416 11.251 1.00 0.00 N ATOM 773 CZ ARG A 56 -13.902 -6.532 11.613 1.00 0.00 C ATOM 774 NH1 ARG A 56 -14.669 -5.480 11.710 1.00 0.00 N ATOM 775 NH2 ARG A 56 -14.373 -7.706 11.932 1.00 0.00 N ATOM 0 H ARG A 56 -14.406 -3.516 7.860 1.00 0.00 H new ATOM 0 HA ARG A 56 -12.853 -5.856 7.011 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -14.794 -5.724 9.342 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -13.326 -6.670 9.200 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -12.362 -4.079 8.854 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -13.664 -3.821 9.997 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -11.082 -5.271 10.365 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -12.040 -4.392 11.540 1.00 0.00 H new ATOM 0 HE ARG A 56 -12.033 -7.225 11.324 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -14.294 -4.554 11.503 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -15.643 -5.584 11.993 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -13.766 -8.525 11.898 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -15.348 -7.805 12.215 1.00 0.00 H new ATOM 789 N ALA A 57 -16.163 -5.905 7.056 1.00 0.00 N ATOM 790 CA ALA A 57 -17.326 -6.653 6.505 1.00 0.00 C ATOM 791 C ALA A 57 -17.461 -6.355 5.011 1.00 0.00 C ATOM 792 O ALA A 57 -16.944 -7.071 4.177 1.00 0.00 O ATOM 793 CB ALA A 57 -18.601 -6.222 7.229 1.00 0.00 C ATOM 0 H ALA A 57 -16.399 -5.070 7.592 1.00 0.00 H new ATOM 0 HA ALA A 57 -17.172 -7.722 6.650 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -19.452 -6.770 6.825 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -18.505 -6.435 8.294 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -18.757 -5.153 7.086 1.00 0.00 H new ATOM 799 N SER A 58 -18.150 -5.303 4.668 1.00 0.00 N ATOM 800 CA SER A 58 -18.314 -4.959 3.226 1.00 0.00 C ATOM 801 C SER A 58 -16.967 -5.106 2.519 1.00 0.00 C ATOM 802 O SER A 58 -16.830 -5.854 1.571 1.00 0.00 O ATOM 803 CB SER A 58 -18.806 -3.517 3.098 1.00 0.00 C ATOM 804 OG SER A 58 -20.185 -3.459 3.435 1.00 0.00 O ATOM 0 H SER A 58 -18.606 -4.667 5.322 1.00 0.00 H new ATOM 0 HA SER A 58 -19.042 -5.629 2.769 1.00 0.00 H new ATOM 0 HB2 SER A 58 -18.231 -2.865 3.756 1.00 0.00 H new ATOM 0 HB3 SER A 58 -18.653 -3.158 2.080 1.00 0.00 H new ATOM 0 HG SER A 58 -20.503 -2.535 3.355 1.00 0.00 H new ATOM 810 N GLY A 59 -15.967 -4.405 2.976 1.00 0.00 N ATOM 811 CA GLY A 59 -14.628 -4.512 2.332 1.00 0.00 C ATOM 812 C GLY A 59 -14.264 -3.182 1.672 1.00 0.00 C ATOM 813 O GLY A 59 -15.051 -2.258 1.633 1.00 0.00 O ATOM 0 H GLY A 59 -16.019 -3.763 3.767 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -13.877 -4.777 3.076 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -14.635 -5.308 1.588 1.00 0.00 H new ATOM 817 N PHE A 60 -13.074 -3.084 1.149 1.00 0.00 N ATOM 818 CA PHE A 60 -12.649 -1.821 0.484 1.00 0.00 C ATOM 819 C PHE A 60 -12.199 -2.137 -0.942 1.00 0.00 C ATOM 820 O PHE A 60 -11.340 -2.969 -1.161 1.00 0.00 O ATOM 821 CB PHE A 60 -11.491 -1.192 1.270 1.00 0.00 C ATOM 822 CG PHE A 60 -10.315 -2.141 1.299 1.00 0.00 C ATOM 823 CD1 PHE A 60 -10.380 -3.315 2.059 1.00 0.00 C ATOM 824 CD2 PHE A 60 -9.159 -1.845 0.567 1.00 0.00 C ATOM 825 CE1 PHE A 60 -9.289 -4.192 2.085 1.00 0.00 C ATOM 826 CE2 PHE A 60 -8.069 -2.724 0.595 1.00 0.00 C ATOM 827 CZ PHE A 60 -8.135 -3.897 1.354 1.00 0.00 C ATOM 0 H PHE A 60 -12.375 -3.827 1.154 1.00 0.00 H new ATOM 0 HA PHE A 60 -13.482 -1.118 0.456 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -11.197 -0.249 0.810 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -11.811 -0.964 2.287 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -11.271 -3.544 2.625 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -9.108 -0.939 -0.019 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -9.339 -5.098 2.671 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -7.177 -2.496 0.030 1.00 0.00 H new ATOM 0 HZ PHE A 60 -7.294 -4.575 1.375 1.00 0.00 H new ATOM 837 N ASP A 61 -12.780 -1.494 -1.917 1.00 0.00 N ATOM 838 CA ASP A 61 -12.391 -1.776 -3.328 1.00 0.00 C ATOM 839 C ASP A 61 -11.630 -0.584 -3.913 1.00 0.00 C ATOM 840 O ASP A 61 -11.698 0.521 -3.411 1.00 0.00 O ATOM 841 CB ASP A 61 -13.647 -2.036 -4.169 1.00 0.00 C ATOM 842 CG ASP A 61 -14.835 -1.270 -3.580 1.00 0.00 C ATOM 843 OD1 ASP A 61 -14.938 -0.083 -3.841 1.00 0.00 O ATOM 844 OD2 ASP A 61 -15.621 -1.886 -2.878 1.00 0.00 O ATOM 0 H ASP A 61 -13.506 -0.787 -1.799 1.00 0.00 H new ATOM 0 HA ASP A 61 -11.749 -2.656 -3.346 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -13.477 -1.724 -5.199 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -13.866 -3.104 -4.191 1.00 0.00 H new ATOM 849 N LEU A 62 -10.911 -0.808 -4.981 1.00 0.00 N ATOM 850 CA LEU A 62 -10.144 0.296 -5.623 1.00 0.00 C ATOM 851 C LEU A 62 -10.441 0.297 -7.124 1.00 0.00 C ATOM 852 O LEU A 62 -11.549 0.036 -7.547 1.00 0.00 O ATOM 853 CB LEU A 62 -8.643 0.079 -5.400 1.00 0.00 C ATOM 854 CG LEU A 62 -8.387 -0.339 -3.954 1.00 0.00 C ATOM 855 CD1 LEU A 62 -7.846 -1.770 -3.928 1.00 0.00 C ATOM 856 CD2 LEU A 62 -7.356 0.605 -3.331 1.00 0.00 C ATOM 0 H LEU A 62 -10.823 -1.715 -5.438 1.00 0.00 H new ATOM 0 HA LEU A 62 -10.436 1.250 -5.185 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -8.273 -0.688 -6.080 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -8.097 0.995 -5.625 1.00 0.00 H new ATOM 0 HG LEU A 62 -9.317 -0.291 -3.388 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -7.662 -2.071 -2.897 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -8.576 -2.443 -4.378 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -6.914 -1.817 -4.491 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -7.170 0.310 -2.298 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -6.426 0.552 -3.897 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -7.737 1.626 -3.354 1.00 0.00 H new ATOM 868 N ALA A 63 -9.459 0.583 -7.932 1.00 0.00 N ATOM 869 CA ALA A 63 -9.682 0.594 -9.403 1.00 0.00 C ATOM 870 C ALA A 63 -9.799 -0.846 -9.915 1.00 0.00 C ATOM 871 O ALA A 63 -9.992 -1.080 -11.092 1.00 0.00 O ATOM 872 CB ALA A 63 -8.500 1.282 -10.086 1.00 0.00 C ATOM 0 H ALA A 63 -8.510 0.810 -7.636 1.00 0.00 H new ATOM 0 HA ALA A 63 -10.602 1.134 -9.629 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -8.659 1.293 -11.164 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -8.415 2.306 -9.722 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -7.582 0.739 -9.860 1.00 0.00 H new ATOM 878 N GLY A 64 -9.681 -1.813 -9.043 1.00 0.00 N ATOM 879 CA GLY A 64 -9.784 -3.234 -9.486 1.00 0.00 C ATOM 880 C GLY A 64 -11.137 -3.810 -9.058 1.00 0.00 C ATOM 881 O GLY A 64 -12.153 -3.552 -9.674 1.00 0.00 O ATOM 0 H GLY A 64 -9.518 -1.680 -8.045 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -9.677 -3.296 -10.569 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -8.974 -3.820 -9.052 1.00 0.00 H new ATOM 885 N VAL A 65 -11.160 -4.590 -8.008 1.00 0.00 N ATOM 886 CA VAL A 65 -12.450 -5.182 -7.544 1.00 0.00 C ATOM 887 C VAL A 65 -12.546 -5.070 -6.019 1.00 0.00 C ATOM 888 O VAL A 65 -12.044 -4.137 -5.424 1.00 0.00 O ATOM 889 CB VAL A 65 -12.522 -6.656 -7.952 1.00 0.00 C ATOM 890 CG1 VAL A 65 -13.981 -7.050 -8.193 1.00 0.00 C ATOM 891 CG2 VAL A 65 -11.720 -6.873 -9.237 1.00 0.00 C ATOM 0 H VAL A 65 -10.342 -4.842 -7.453 1.00 0.00 H new ATOM 0 HA VAL A 65 -13.278 -4.641 -8.003 1.00 0.00 H new ATOM 0 HB VAL A 65 -12.105 -7.271 -7.154 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -14.031 -8.099 -8.483 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -14.555 -6.899 -7.279 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -14.398 -6.433 -8.989 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -11.772 -7.923 -9.526 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -12.136 -6.256 -10.034 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -10.680 -6.595 -9.068 1.00 0.00 H new ATOM 901 N HIS A 66 -13.188 -6.013 -5.380 1.00 0.00 N ATOM 902 CA HIS A 66 -13.314 -5.952 -3.893 1.00 0.00 C ATOM 903 C HIS A 66 -12.041 -6.507 -3.249 1.00 0.00 C ATOM 904 O HIS A 66 -11.544 -7.548 -3.632 1.00 0.00 O ATOM 905 CB HIS A 66 -14.515 -6.787 -3.431 1.00 0.00 C ATOM 906 CG HIS A 66 -15.528 -6.894 -4.538 1.00 0.00 C ATOM 907 ND1 HIS A 66 -16.508 -5.935 -4.740 1.00 0.00 N ATOM 908 CD2 HIS A 66 -15.728 -7.844 -5.508 1.00 0.00 C ATOM 909 CE1 HIS A 66 -17.246 -6.325 -5.794 1.00 0.00 C ATOM 910 NE2 HIS A 66 -16.814 -7.483 -6.300 1.00 0.00 N ATOM 0 H HIS A 66 -13.629 -6.820 -5.821 1.00 0.00 H new ATOM 0 HA HIS A 66 -13.460 -4.914 -3.593 1.00 0.00 H new ATOM 0 HB2 HIS A 66 -14.183 -7.782 -3.134 1.00 0.00 H new ATOM 0 HB3 HIS A 66 -14.971 -6.328 -2.554 1.00 0.00 H new ATOM 0 HD2 HIS A 66 -15.133 -8.736 -5.637 1.00 0.00 H new ATOM 0 HE1 HIS A 66 -18.086 -5.769 -6.184 1.00 0.00 H new ATOM 0 HE2 HIS A 66 -17.197 -7.993 -7.096 1.00 0.00 H new ATOM 918 N TYR A 67 -11.510 -5.824 -2.271 1.00 0.00 N ATOM 919 CA TYR A 67 -10.270 -6.315 -1.602 1.00 0.00 C ATOM 920 C TYR A 67 -10.592 -6.716 -0.160 1.00 0.00 C ATOM 921 O TYR A 67 -11.446 -6.136 0.480 1.00 0.00 O ATOM 922 CB TYR A 67 -9.223 -5.199 -1.595 1.00 0.00 C ATOM 923 CG TYR A 67 -8.361 -5.284 -2.835 1.00 0.00 C ATOM 924 CD1 TYR A 67 -8.773 -6.046 -3.937 1.00 0.00 C ATOM 925 CD2 TYR A 67 -7.146 -4.589 -2.882 1.00 0.00 C ATOM 926 CE1 TYR A 67 -7.968 -6.115 -5.081 1.00 0.00 C ATOM 927 CE2 TYR A 67 -6.343 -4.658 -4.025 1.00 0.00 C ATOM 928 CZ TYR A 67 -6.754 -5.421 -5.125 1.00 0.00 C ATOM 929 OH TYR A 67 -5.961 -5.488 -6.252 1.00 0.00 O ATOM 0 H TYR A 67 -11.881 -4.947 -1.906 1.00 0.00 H new ATOM 0 HA TYR A 67 -9.883 -7.179 -2.142 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -9.716 -4.228 -1.552 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -8.600 -5.280 -0.704 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -9.711 -6.580 -3.904 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -6.829 -3.999 -2.035 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -8.284 -6.704 -5.929 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -5.406 -4.123 -4.059 1.00 0.00 H new ATOM 0 HH TYR A 67 -5.155 -4.948 -6.117 1.00 0.00 H new ATOM 939 N VAL A 68 -9.910 -7.703 0.361 1.00 0.00 N ATOM 940 CA VAL A 68 -10.176 -8.137 1.763 1.00 0.00 C ATOM 941 C VAL A 68 -9.220 -7.407 2.709 1.00 0.00 C ATOM 942 O VAL A 68 -8.074 -7.169 2.384 1.00 0.00 O ATOM 943 CB VAL A 68 -9.959 -9.648 1.885 1.00 0.00 C ATOM 944 CG1 VAL A 68 -10.703 -10.175 3.112 1.00 0.00 C ATOM 945 CG2 VAL A 68 -10.496 -10.341 0.632 1.00 0.00 C ATOM 0 H VAL A 68 -9.181 -8.226 -0.124 1.00 0.00 H new ATOM 0 HA VAL A 68 -11.206 -7.899 2.027 1.00 0.00 H new ATOM 0 HB VAL A 68 -8.894 -9.853 1.990 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -10.548 -11.250 3.198 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -10.324 -9.681 4.007 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -11.768 -9.969 3.008 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -10.342 -11.417 0.717 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -11.561 -10.134 0.530 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -9.968 -9.967 -0.245 1.00 0.00 H new ATOM 955 N THR A 69 -9.682 -7.046 3.874 1.00 0.00 N ATOM 956 CA THR A 69 -8.800 -6.327 4.834 1.00 0.00 C ATOM 957 C THR A 69 -8.438 -7.256 5.994 1.00 0.00 C ATOM 958 O THR A 69 -9.293 -7.724 6.719 1.00 0.00 O ATOM 959 CB THR A 69 -9.529 -5.094 5.376 1.00 0.00 C ATOM 960 OG1 THR A 69 -10.439 -4.614 4.395 1.00 0.00 O ATOM 961 CG2 THR A 69 -8.510 -4.002 5.706 1.00 0.00 C ATOM 0 H THR A 69 -10.632 -7.218 4.202 1.00 0.00 H new ATOM 0 HA THR A 69 -7.890 -6.015 4.322 1.00 0.00 H new ATOM 0 HB THR A 69 -10.077 -5.363 6.279 1.00 0.00 H new ATOM 0 HG1 THR A 69 -9.956 -4.067 3.741 1.00 0.00 H new ATOM 0 HG21 THR A 69 -9.029 -3.125 6.092 1.00 0.00 H new ATOM 0 HG22 THR A 69 -7.812 -4.371 6.458 1.00 0.00 H new ATOM 0 HG23 THR A 69 -7.961 -3.732 4.804 1.00 0.00 H new ATOM 969 N LEU A 70 -7.174 -7.529 6.176 1.00 0.00 N ATOM 970 CA LEU A 70 -6.757 -8.429 7.288 1.00 0.00 C ATOM 971 C LEU A 70 -5.994 -7.624 8.340 1.00 0.00 C ATOM 972 O LEU A 70 -5.239 -8.167 9.122 1.00 0.00 O ATOM 973 CB LEU A 70 -5.850 -9.533 6.741 1.00 0.00 C ATOM 974 CG LEU A 70 -4.626 -8.903 6.074 1.00 0.00 C ATOM 975 CD1 LEU A 70 -3.395 -9.128 6.955 1.00 0.00 C ATOM 976 CD2 LEU A 70 -4.401 -9.553 4.708 1.00 0.00 C ATOM 0 H LEU A 70 -6.412 -7.167 5.602 1.00 0.00 H new ATOM 0 HA LEU A 70 -7.642 -8.875 7.741 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -5.537 -10.195 7.549 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -6.396 -10.144 6.022 1.00 0.00 H new ATOM 0 HG LEU A 70 -4.791 -7.833 5.945 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -2.522 -8.680 6.481 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -3.556 -8.667 7.930 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -3.229 -10.198 7.083 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -3.529 -9.105 4.231 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -4.235 -10.623 4.837 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -5.279 -9.395 4.081 1.00 0.00 H new ATOM 988 N ARG A 71 -6.180 -6.334 8.368 1.00 0.00 N ATOM 989 CA ARG A 71 -5.461 -5.505 9.373 1.00 0.00 C ATOM 990 C ARG A 71 -5.796 -4.029 9.152 1.00 0.00 C ATOM 991 O ARG A 71 -5.276 -3.389 8.260 1.00 0.00 O ATOM 992 CB ARG A 71 -3.955 -5.714 9.219 1.00 0.00 C ATOM 993 CG ARG A 71 -3.297 -5.751 10.599 1.00 0.00 C ATOM 994 CD ARG A 71 -1.890 -6.332 10.471 1.00 0.00 C ATOM 995 NE ARG A 71 -1.633 -7.291 11.593 1.00 0.00 N ATOM 996 CZ ARG A 71 -1.841 -6.952 12.839 1.00 0.00 C ATOM 997 NH1 ARG A 71 -2.113 -5.714 13.154 1.00 0.00 N ATOM 998 NH2 ARG A 71 -1.723 -7.848 13.781 1.00 0.00 N ATOM 0 H ARG A 71 -6.797 -5.819 7.740 1.00 0.00 H new ATOM 0 HA ARG A 71 -5.770 -5.800 10.376 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -3.760 -6.645 8.687 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -3.525 -4.910 8.622 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -3.251 -4.747 11.020 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -3.892 -6.356 11.282 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -1.783 -6.841 9.513 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -1.152 -5.530 10.490 1.00 0.00 H new ATOM 0 HE ARG A 71 -1.289 -8.227 11.381 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -2.165 -5.002 12.425 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -2.274 -5.459 14.129 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -1.470 -8.807 13.544 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -1.884 -7.589 14.754 1.00 0.00 H new ATOM 1012 N ALA A 72 -6.661 -3.483 9.961 1.00 0.00 N ATOM 1013 CA ALA A 72 -7.030 -2.048 9.804 1.00 0.00 C ATOM 1014 C ALA A 72 -7.486 -1.498 11.155 1.00 0.00 C ATOM 1015 O ALA A 72 -8.571 -0.966 11.288 1.00 0.00 O ATOM 1016 CB ALA A 72 -8.171 -1.920 8.790 1.00 0.00 C ATOM 0 H ALA A 72 -7.129 -3.970 10.726 1.00 0.00 H new ATOM 0 HA ALA A 72 -6.167 -1.484 9.449 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -8.440 -0.870 8.676 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -7.849 -2.319 7.828 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -9.037 -2.480 9.144 1.00 0.00 H new ATOM 1022 N ASP A 73 -6.671 -1.631 12.166 1.00 0.00 N ATOM 1023 CA ASP A 73 -7.066 -1.126 13.510 1.00 0.00 C ATOM 1024 C ASP A 73 -5.977 -0.203 14.068 1.00 0.00 C ATOM 1025 O ASP A 73 -6.208 0.548 14.996 1.00 0.00 O ATOM 1026 CB ASP A 73 -7.259 -2.314 14.456 1.00 0.00 C ATOM 1027 CG ASP A 73 -8.644 -2.923 14.234 1.00 0.00 C ATOM 1028 OD1 ASP A 73 -8.825 -3.581 13.223 1.00 0.00 O ATOM 1029 OD2 ASP A 73 -9.500 -2.722 15.079 1.00 0.00 O ATOM 0 H ASP A 73 -5.750 -2.067 12.119 1.00 0.00 H new ATOM 0 HA ASP A 73 -7.996 -0.564 13.423 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -6.488 -3.063 14.278 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -7.155 -1.989 15.491 1.00 0.00 H new ATOM 1034 N ASP A 74 -4.793 -0.251 13.520 1.00 0.00 N ATOM 1035 CA ASP A 74 -3.703 0.625 14.037 1.00 0.00 C ATOM 1036 C ASP A 74 -3.365 1.702 12.996 1.00 0.00 C ATOM 1037 O ASP A 74 -4.098 2.655 12.824 1.00 0.00 O ATOM 1038 CB ASP A 74 -2.465 -0.227 14.332 1.00 0.00 C ATOM 1039 CG ASP A 74 -2.356 -1.342 13.292 1.00 0.00 C ATOM 1040 OD1 ASP A 74 -2.596 -1.067 12.128 1.00 0.00 O ATOM 1041 OD2 ASP A 74 -2.036 -2.456 13.678 1.00 0.00 O ATOM 0 H ASP A 74 -4.534 -0.856 12.740 1.00 0.00 H new ATOM 0 HA ASP A 74 -4.031 1.113 14.955 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -1.569 0.394 14.311 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -2.534 -0.654 15.333 1.00 0.00 H new ATOM 1046 N ARG A 75 -2.263 1.566 12.302 1.00 0.00 N ATOM 1047 CA ARG A 75 -1.895 2.593 11.283 1.00 0.00 C ATOM 1048 C ARG A 75 -1.241 1.902 10.083 1.00 0.00 C ATOM 1049 O ARG A 75 -0.439 2.481 9.379 1.00 0.00 O ATOM 1050 CB ARG A 75 -0.915 3.615 11.880 1.00 0.00 C ATOM 1051 CG ARG A 75 -0.300 3.078 13.181 1.00 0.00 C ATOM 1052 CD ARG A 75 0.336 4.231 13.965 1.00 0.00 C ATOM 1053 NE ARG A 75 0.847 5.269 13.014 1.00 0.00 N ATOM 1054 CZ ARG A 75 1.679 4.961 12.057 1.00 0.00 C ATOM 1055 NH1 ARG A 75 2.248 3.786 12.030 1.00 0.00 N ATOM 1056 NH2 ARG A 75 1.984 5.851 11.151 1.00 0.00 N ATOM 0 H ARG A 75 -1.606 0.792 12.397 1.00 0.00 H new ATOM 0 HA ARG A 75 -2.797 3.116 10.966 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -0.125 3.833 11.161 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -1.434 4.553 12.077 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -1.068 2.594 13.785 1.00 0.00 H new ATOM 0 HG3 ARG A 75 0.451 2.321 12.954 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -0.397 4.672 14.640 1.00 0.00 H new ATOM 0 HD3 ARG A 75 1.153 3.857 14.582 1.00 0.00 H new ATOM 0 HE ARG A 75 0.539 6.236 13.116 1.00 0.00 H new ATOM 0 HH11 ARG A 75 2.043 3.103 12.759 1.00 0.00 H new ATOM 0 HH12 ARG A 75 2.897 3.551 11.279 1.00 0.00 H new ATOM 0 HH21 ARG A 75 1.572 6.783 11.193 1.00 0.00 H new ATOM 0 HH22 ARG A 75 2.634 5.614 10.402 1.00 0.00 H new ATOM 1070 N SER A 76 -1.584 0.667 9.848 1.00 0.00 N ATOM 1071 CA SER A 76 -0.995 -0.074 8.698 1.00 0.00 C ATOM 1072 C SER A 76 -2.074 -0.976 8.094 1.00 0.00 C ATOM 1073 O SER A 76 -2.740 -1.712 8.795 1.00 0.00 O ATOM 1074 CB SER A 76 0.173 -0.925 9.196 1.00 0.00 C ATOM 1075 OG SER A 76 1.397 -0.272 8.883 1.00 0.00 O ATOM 0 H SER A 76 -2.251 0.135 10.407 1.00 0.00 H new ATOM 0 HA SER A 76 -0.634 0.623 7.942 1.00 0.00 H new ATOM 0 HB2 SER A 76 0.094 -1.078 10.272 1.00 0.00 H new ATOM 0 HB3 SER A 76 0.144 -1.911 8.731 1.00 0.00 H new ATOM 0 HG SER A 76 2.036 -0.926 8.530 1.00 0.00 H new ATOM 1081 N ILE A 77 -2.273 -0.916 6.804 1.00 0.00 N ATOM 1082 CA ILE A 77 -3.332 -1.762 6.186 1.00 0.00 C ATOM 1083 C ILE A 77 -2.808 -2.470 4.932 1.00 0.00 C ATOM 1084 O ILE A 77 -2.771 -1.903 3.857 1.00 0.00 O ATOM 1085 CB ILE A 77 -4.516 -0.880 5.795 1.00 0.00 C ATOM 1086 CG1 ILE A 77 -5.186 -0.339 7.059 1.00 0.00 C ATOM 1087 CG2 ILE A 77 -5.526 -1.702 4.994 1.00 0.00 C ATOM 1088 CD1 ILE A 77 -5.008 1.178 7.120 1.00 0.00 C ATOM 0 H ILE A 77 -1.753 -0.323 6.157 1.00 0.00 H new ATOM 0 HA ILE A 77 -3.638 -2.515 6.912 1.00 0.00 H new ATOM 0 HB ILE A 77 -4.163 -0.049 5.185 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -6.246 -0.592 7.058 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -4.748 -0.803 7.943 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -6.370 -1.071 4.716 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -5.049 -2.087 4.093 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -5.880 -2.535 5.601 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -5.485 1.564 8.021 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -3.945 1.419 7.141 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -5.466 1.634 6.242 1.00 0.00 H new ATOM 1100 N TYR A 78 -2.436 -3.715 5.051 1.00 0.00 N ATOM 1101 CA TYR A 78 -1.957 -4.469 3.858 1.00 0.00 C ATOM 1102 C TYR A 78 -3.023 -5.508 3.504 1.00 0.00 C ATOM 1103 O TYR A 78 -3.080 -6.574 4.084 1.00 0.00 O ATOM 1104 CB TYR A 78 -0.632 -5.175 4.167 1.00 0.00 C ATOM 1105 CG TYR A 78 0.125 -4.415 5.230 1.00 0.00 C ATOM 1106 CD1 TYR A 78 -0.230 -4.562 6.575 1.00 0.00 C ATOM 1107 CD2 TYR A 78 1.189 -3.570 4.875 1.00 0.00 C ATOM 1108 CE1 TYR A 78 0.471 -3.867 7.564 1.00 0.00 C ATOM 1109 CE2 TYR A 78 1.891 -2.876 5.867 1.00 0.00 C ATOM 1110 CZ TYR A 78 1.533 -3.025 7.212 1.00 0.00 C ATOM 1111 OH TYR A 78 2.224 -2.339 8.191 1.00 0.00 O ATOM 0 H TYR A 78 -2.443 -4.243 5.924 1.00 0.00 H new ATOM 0 HA TYR A 78 -1.791 -3.785 3.026 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -0.824 -6.194 4.504 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -0.029 -5.247 3.262 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -1.047 -5.213 6.849 1.00 0.00 H new ATOM 0 HD2 TYR A 78 1.465 -3.456 3.837 1.00 0.00 H new ATOM 0 HE1 TYR A 78 0.193 -3.979 8.602 1.00 0.00 H new ATOM 0 HE2 TYR A 78 2.709 -2.225 5.595 1.00 0.00 H new ATOM 0 HH TYR A 78 3.150 -2.202 7.902 1.00 0.00 H new ATOM 1121 N GLY A 79 -3.886 -5.198 2.576 1.00 0.00 N ATOM 1122 CA GLY A 79 -4.966 -6.159 2.211 1.00 0.00 C ATOM 1123 C GLY A 79 -4.463 -7.157 1.166 1.00 0.00 C ATOM 1124 O GLY A 79 -3.403 -6.995 0.594 1.00 0.00 O ATOM 0 H GLY A 79 -3.890 -4.321 2.055 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -5.302 -6.693 3.100 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -5.827 -5.617 1.820 1.00 0.00 H new ATOM 1128 N LYS A 80 -5.224 -8.189 0.915 1.00 0.00 N ATOM 1129 CA LYS A 80 -4.811 -9.207 -0.092 1.00 0.00 C ATOM 1130 C LYS A 80 -6.061 -9.827 -0.719 1.00 0.00 C ATOM 1131 O LYS A 80 -7.119 -9.844 -0.124 1.00 0.00 O ATOM 1132 CB LYS A 80 -3.985 -10.298 0.592 1.00 0.00 C ATOM 1133 CG LYS A 80 -2.922 -10.820 -0.377 1.00 0.00 C ATOM 1134 CD LYS A 80 -2.376 -12.159 0.126 1.00 0.00 C ATOM 1135 CE LYS A 80 -1.104 -12.514 -0.647 1.00 0.00 C ATOM 1136 NZ LYS A 80 -0.919 -13.994 -0.645 1.00 0.00 N ATOM 0 H LYS A 80 -6.120 -8.371 1.368 1.00 0.00 H new ATOM 0 HA LYS A 80 -4.208 -8.734 -0.867 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -3.510 -9.900 1.489 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -4.634 -11.114 0.910 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -3.352 -10.942 -1.371 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -2.112 -10.097 -0.467 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -2.161 -12.099 1.193 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -3.124 -12.941 -0.005 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -1.173 -12.147 -1.671 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -0.241 -12.028 -0.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 0.066 -14.221 -0.889 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -1.138 -14.370 0.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -1.557 -14.425 -1.345 1.00 0.00 H new ATOM 1150 N LYS A 81 -5.955 -10.334 -1.916 1.00 0.00 N ATOM 1151 CA LYS A 81 -7.148 -10.946 -2.568 1.00 0.00 C ATOM 1152 C LYS A 81 -6.882 -12.428 -2.846 1.00 0.00 C ATOM 1153 O LYS A 81 -7.784 -13.181 -3.149 1.00 0.00 O ATOM 1154 CB LYS A 81 -7.442 -10.216 -3.883 1.00 0.00 C ATOM 1155 CG LYS A 81 -6.442 -10.656 -4.955 1.00 0.00 C ATOM 1156 CD LYS A 81 -7.179 -11.437 -6.045 1.00 0.00 C ATOM 1157 CE LYS A 81 -6.182 -11.888 -7.114 1.00 0.00 C ATOM 1158 NZ LYS A 81 -5.702 -10.703 -7.879 1.00 0.00 N ATOM 0 H LYS A 81 -5.098 -10.351 -2.469 1.00 0.00 H new ATOM 0 HA LYS A 81 -8.009 -10.857 -1.905 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -8.459 -10.433 -4.210 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -7.378 -9.138 -3.733 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -5.948 -9.786 -5.387 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -5.664 -11.276 -4.510 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -7.679 -12.303 -5.611 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -7.952 -10.814 -6.494 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -5.339 -12.399 -6.648 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -6.654 -12.602 -7.788 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -5.899 -10.840 -8.891 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -6.194 -9.850 -7.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -4.678 -10.590 -7.738 1.00 0.00 H new ATOM 1172 N GLY A 82 -5.652 -12.851 -2.748 1.00 0.00 N ATOM 1173 CA GLY A 82 -5.336 -14.283 -3.009 1.00 0.00 C ATOM 1174 C GLY A 82 -3.903 -14.405 -3.529 1.00 0.00 C ATOM 1175 O GLY A 82 -3.002 -14.787 -2.809 1.00 0.00 O ATOM 0 H GLY A 82 -4.853 -12.268 -2.499 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -5.452 -14.864 -2.094 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -6.035 -14.693 -3.738 1.00 0.00 H new ATOM 1179 N SER A 83 -3.681 -14.083 -4.776 1.00 0.00 N ATOM 1180 CA SER A 83 -2.303 -14.182 -5.334 1.00 0.00 C ATOM 1181 C SER A 83 -1.614 -12.820 -5.230 1.00 0.00 C ATOM 1182 O SER A 83 -0.448 -12.728 -4.902 1.00 0.00 O ATOM 1183 CB SER A 83 -2.373 -14.609 -6.801 1.00 0.00 C ATOM 1184 OG SER A 83 -3.131 -13.654 -7.533 1.00 0.00 O ATOM 0 H SER A 83 -4.393 -13.757 -5.430 1.00 0.00 H new ATOM 0 HA SER A 83 -1.735 -14.922 -4.770 1.00 0.00 H new ATOM 0 HB2 SER A 83 -1.369 -14.689 -7.217 1.00 0.00 H new ATOM 0 HB3 SER A 83 -2.831 -15.594 -6.883 1.00 0.00 H new ATOM 0 HG SER A 83 -3.176 -13.924 -8.474 1.00 0.00 H new ATOM 1190 N ALA A 84 -2.325 -11.763 -5.506 1.00 0.00 N ATOM 1191 CA ALA A 84 -1.709 -10.408 -5.422 1.00 0.00 C ATOM 1192 C ALA A 84 -2.074 -9.767 -4.081 1.00 0.00 C ATOM 1193 O ALA A 84 -3.154 -9.965 -3.560 1.00 0.00 O ATOM 1194 CB ALA A 84 -2.234 -9.539 -6.567 1.00 0.00 C ATOM 0 H ALA A 84 -3.306 -11.778 -5.786 1.00 0.00 H new ATOM 0 HA ALA A 84 -0.625 -10.493 -5.500 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -1.785 -8.548 -6.507 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -1.974 -9.998 -7.521 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -3.318 -9.451 -6.490 1.00 0.00 H new ATOM 1200 N GLY A 85 -1.183 -9.000 -3.514 1.00 0.00 N ATOM 1201 CA GLY A 85 -1.483 -8.352 -2.206 1.00 0.00 C ATOM 1202 C GLY A 85 -0.967 -6.910 -2.217 1.00 0.00 C ATOM 1203 O GLY A 85 0.065 -6.615 -2.784 1.00 0.00 O ATOM 0 H GLY A 85 -0.261 -8.794 -3.900 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -2.557 -8.363 -2.021 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -1.014 -8.911 -1.396 1.00 0.00 H new ATOM 1207 N VAL A 86 -1.682 -6.011 -1.598 1.00 0.00 N ATOM 1208 CA VAL A 86 -1.236 -4.589 -1.574 1.00 0.00 C ATOM 1209 C VAL A 86 -0.794 -4.214 -0.156 1.00 0.00 C ATOM 1210 O VAL A 86 -1.447 -4.541 0.816 1.00 0.00 O ATOM 1211 CB VAL A 86 -2.393 -3.686 -2.004 1.00 0.00 C ATOM 1212 CG1 VAL A 86 -3.658 -4.080 -1.238 1.00 0.00 C ATOM 1213 CG2 VAL A 86 -2.041 -2.229 -1.695 1.00 0.00 C ATOM 0 H VAL A 86 -2.556 -6.200 -1.108 1.00 0.00 H new ATOM 0 HA VAL A 86 -0.399 -4.459 -2.260 1.00 0.00 H new ATOM 0 HB VAL A 86 -2.567 -3.799 -3.074 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -4.483 -3.437 -1.544 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -3.907 -5.119 -1.456 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -3.486 -3.965 -0.168 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -2.864 -1.583 -2.001 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -1.869 -2.115 -0.625 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -1.139 -1.949 -2.239 1.00 0.00 H new ATOM 1223 N ILE A 87 0.310 -3.527 -0.036 1.00 0.00 N ATOM 1224 CA ILE A 87 0.805 -3.121 1.312 1.00 0.00 C ATOM 1225 C ILE A 87 0.647 -1.603 1.466 1.00 0.00 C ATOM 1226 O ILE A 87 1.519 -0.837 1.107 1.00 0.00 O ATOM 1227 CB ILE A 87 2.282 -3.538 1.445 1.00 0.00 C ATOM 1228 CG1 ILE A 87 2.350 -4.960 2.011 1.00 0.00 C ATOM 1229 CG2 ILE A 87 3.044 -2.586 2.377 1.00 0.00 C ATOM 1230 CD1 ILE A 87 3.682 -5.604 1.622 1.00 0.00 C ATOM 0 H ILE A 87 0.893 -3.228 -0.817 1.00 0.00 H new ATOM 0 HA ILE A 87 0.230 -3.611 2.098 1.00 0.00 H new ATOM 0 HB ILE A 87 2.745 -3.497 0.459 1.00 0.00 H new ATOM 0 HG12 ILE A 87 2.250 -4.936 3.096 1.00 0.00 H new ATOM 0 HG13 ILE A 87 1.521 -5.555 1.627 1.00 0.00 H new ATOM 0 HG21 ILE A 87 4.084 -2.905 2.452 1.00 0.00 H new ATOM 0 HG22 ILE A 87 3.003 -1.573 1.975 1.00 0.00 H new ATOM 0 HG23 ILE A 87 2.587 -2.603 3.367 1.00 0.00 H new ATOM 0 HD11 ILE A 87 3.729 -6.615 2.025 1.00 0.00 H new ATOM 0 HD12 ILE A 87 3.764 -5.642 0.536 1.00 0.00 H new ATOM 0 HD13 ILE A 87 4.504 -5.013 2.027 1.00 0.00 H new ATOM 1242 N THR A 88 -0.463 -1.161 1.993 1.00 0.00 N ATOM 1243 CA THR A 88 -0.671 0.305 2.159 1.00 0.00 C ATOM 1244 C THR A 88 -0.132 0.751 3.518 1.00 0.00 C ATOM 1245 O THR A 88 -0.663 0.402 4.553 1.00 0.00 O ATOM 1246 CB THR A 88 -2.164 0.636 2.077 1.00 0.00 C ATOM 1247 OG1 THR A 88 -2.775 0.364 3.329 1.00 0.00 O ATOM 1248 CG2 THR A 88 -2.836 -0.203 0.988 1.00 0.00 C ATOM 0 H THR A 88 -1.232 -1.750 2.314 1.00 0.00 H new ATOM 0 HA THR A 88 -0.141 0.828 1.363 1.00 0.00 H new ATOM 0 HB THR A 88 -2.280 1.691 1.830 1.00 0.00 H new ATOM 0 HG1 THR A 88 -2.281 -0.348 3.786 1.00 0.00 H new ATOM 0 HG21 THR A 88 -3.897 0.043 0.942 1.00 0.00 H new ATOM 0 HG22 THR A 88 -2.371 0.011 0.025 1.00 0.00 H new ATOM 0 HG23 THR A 88 -2.719 -1.262 1.220 1.00 0.00 H new ATOM 1256 N VAL A 89 0.914 1.532 3.523 1.00 0.00 N ATOM 1257 CA VAL A 89 1.482 2.016 4.811 1.00 0.00 C ATOM 1258 C VAL A 89 1.239 3.522 4.923 1.00 0.00 C ATOM 1259 O VAL A 89 1.402 4.257 3.970 1.00 0.00 O ATOM 1260 CB VAL A 89 2.984 1.733 4.851 1.00 0.00 C ATOM 1261 CG1 VAL A 89 3.545 2.129 6.217 1.00 0.00 C ATOM 1262 CG2 VAL A 89 3.230 0.241 4.613 1.00 0.00 C ATOM 0 H VAL A 89 1.400 1.856 2.687 1.00 0.00 H new ATOM 0 HA VAL A 89 1.002 1.501 5.643 1.00 0.00 H new ATOM 0 HB VAL A 89 3.481 2.313 4.073 1.00 0.00 H new ATOM 0 HG11 VAL A 89 4.616 1.926 6.243 1.00 0.00 H new ATOM 0 HG12 VAL A 89 3.373 3.192 6.387 1.00 0.00 H new ATOM 0 HG13 VAL A 89 3.047 1.552 6.996 1.00 0.00 H new ATOM 0 HG21 VAL A 89 4.301 0.040 4.642 1.00 0.00 H new ATOM 0 HG22 VAL A 89 2.731 -0.338 5.390 1.00 0.00 H new ATOM 0 HG23 VAL A 89 2.834 -0.042 3.638 1.00 0.00 H new ATOM 1272 N LYS A 90 0.837 3.990 6.074 1.00 0.00 N ATOM 1273 CA LYS A 90 0.572 5.448 6.227 1.00 0.00 C ATOM 1274 C LYS A 90 1.736 6.118 6.957 1.00 0.00 C ATOM 1275 O LYS A 90 2.409 5.512 7.768 1.00 0.00 O ATOM 1276 CB LYS A 90 -0.715 5.648 7.029 1.00 0.00 C ATOM 1277 CG LYS A 90 -1.792 6.249 6.124 1.00 0.00 C ATOM 1278 CD LYS A 90 -2.258 7.587 6.704 1.00 0.00 C ATOM 1279 CE LYS A 90 -2.757 7.377 8.133 1.00 0.00 C ATOM 1280 NZ LYS A 90 -1.802 8.005 9.089 1.00 0.00 N ATOM 0 H LYS A 90 0.681 3.428 6.911 1.00 0.00 H new ATOM 0 HA LYS A 90 0.464 5.898 5.240 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -1.056 4.695 7.434 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -0.529 6.307 7.877 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -1.398 6.394 5.118 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -2.635 5.564 6.040 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -1.438 8.305 6.696 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -3.054 8.005 6.087 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -3.748 7.815 8.252 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -2.852 6.312 8.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -1.595 7.339 9.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -0.920 8.244 8.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -2.223 8.871 9.482 1.00 0.00 H new ATOM 1294 N THR A 91 1.973 7.369 6.677 1.00 0.00 N ATOM 1295 CA THR A 91 3.087 8.092 7.354 1.00 0.00 C ATOM 1296 C THR A 91 2.576 9.449 7.846 1.00 0.00 C ATOM 1297 O THR A 91 1.441 9.581 8.258 1.00 0.00 O ATOM 1298 CB THR A 91 4.237 8.299 6.365 1.00 0.00 C ATOM 1299 OG1 THR A 91 3.811 9.161 5.319 1.00 0.00 O ATOM 1300 CG2 THR A 91 4.652 6.951 5.778 1.00 0.00 C ATOM 0 H THR A 91 1.442 7.924 6.006 1.00 0.00 H new ATOM 0 HA THR A 91 3.446 7.508 8.202 1.00 0.00 H new ATOM 0 HB THR A 91 5.086 8.747 6.882 1.00 0.00 H new ATOM 0 HG1 THR A 91 3.102 8.724 4.803 1.00 0.00 H new ATOM 0 HG21 THR A 91 5.471 7.097 5.074 1.00 0.00 H new ATOM 0 HG22 THR A 91 4.978 6.289 6.581 1.00 0.00 H new ATOM 0 HG23 THR A 91 3.804 6.503 5.260 1.00 0.00 H new ATOM 1308 N SER A 92 3.400 10.461 7.807 1.00 0.00 N ATOM 1309 CA SER A 92 2.949 11.803 8.273 1.00 0.00 C ATOM 1310 C SER A 92 2.280 12.546 7.115 1.00 0.00 C ATOM 1311 O SER A 92 1.399 13.358 7.315 1.00 0.00 O ATOM 1312 CB SER A 92 4.155 12.605 8.764 1.00 0.00 C ATOM 1313 OG SER A 92 3.718 13.881 9.213 1.00 0.00 O ATOM 0 H SER A 92 4.363 10.417 7.474 1.00 0.00 H new ATOM 0 HA SER A 92 2.236 11.683 9.089 1.00 0.00 H new ATOM 0 HB2 SER A 92 4.655 12.073 9.574 1.00 0.00 H new ATOM 0 HB3 SER A 92 4.882 12.719 7.960 1.00 0.00 H new ATOM 0 HG SER A 92 4.488 14.398 9.530 1.00 0.00 H new ATOM 1319 N LYS A 93 2.691 12.278 5.904 1.00 0.00 N ATOM 1320 CA LYS A 93 2.078 12.976 4.736 1.00 0.00 C ATOM 1321 C LYS A 93 2.331 12.170 3.459 1.00 0.00 C ATOM 1322 O LYS A 93 2.883 12.675 2.502 1.00 0.00 O ATOM 1323 CB LYS A 93 2.716 14.358 4.576 1.00 0.00 C ATOM 1324 CG LYS A 93 1.979 15.384 5.437 1.00 0.00 C ATOM 1325 CD LYS A 93 2.561 16.772 5.163 1.00 0.00 C ATOM 1326 CE LYS A 93 2.094 17.749 6.240 1.00 0.00 C ATOM 1327 NZ LYS A 93 1.415 18.907 5.593 1.00 0.00 N ATOM 0 H LYS A 93 3.424 11.607 5.673 1.00 0.00 H new ATOM 0 HA LYS A 93 1.006 13.074 4.904 1.00 0.00 H new ATOM 0 HB2 LYS A 93 3.766 14.317 4.865 1.00 0.00 H new ATOM 0 HB3 LYS A 93 2.685 14.662 3.530 1.00 0.00 H new ATOM 0 HG2 LYS A 93 0.913 15.371 5.209 1.00 0.00 H new ATOM 0 HG3 LYS A 93 2.083 15.134 6.493 1.00 0.00 H new ATOM 0 HD2 LYS A 93 3.650 16.724 5.150 1.00 0.00 H new ATOM 0 HD3 LYS A 93 2.245 17.122 4.180 1.00 0.00 H new ATOM 0 HE2 LYS A 93 1.411 17.251 6.928 1.00 0.00 H new ATOM 0 HE3 LYS A 93 2.944 18.094 6.828 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 1.096 19.575 6.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 2.080 19.386 4.953 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 0.595 18.569 5.050 1.00 0.00 H new ATOM 1341 N SER A 94 1.941 10.925 3.427 1.00 0.00 N ATOM 1342 CA SER A 94 2.177 10.118 2.195 1.00 0.00 C ATOM 1343 C SER A 94 1.592 8.716 2.362 1.00 0.00 C ATOM 1344 O SER A 94 1.518 8.186 3.452 1.00 0.00 O ATOM 1345 CB SER A 94 3.683 10.016 1.944 1.00 0.00 C ATOM 1346 OG SER A 94 4.015 8.685 1.566 1.00 0.00 O ATOM 0 H SER A 94 1.474 10.436 4.191 1.00 0.00 H new ATOM 0 HA SER A 94 1.691 10.604 1.349 1.00 0.00 H new ATOM 0 HB2 SER A 94 3.979 10.712 1.159 1.00 0.00 H new ATOM 0 HB3 SER A 94 4.232 10.297 2.843 1.00 0.00 H new ATOM 0 HG SER A 94 4.982 8.553 1.650 1.00 0.00 H new ATOM 1352 N ILE A 95 1.194 8.107 1.279 1.00 0.00 N ATOM 1353 CA ILE A 95 0.632 6.732 1.355 1.00 0.00 C ATOM 1354 C ILE A 95 1.431 5.838 0.406 1.00 0.00 C ATOM 1355 O ILE A 95 1.589 6.143 -0.760 1.00 0.00 O ATOM 1356 CB ILE A 95 -0.843 6.755 0.946 1.00 0.00 C ATOM 1357 CG1 ILE A 95 -1.675 7.329 2.096 1.00 0.00 C ATOM 1358 CG2 ILE A 95 -1.317 5.333 0.640 1.00 0.00 C ATOM 1359 CD1 ILE A 95 -2.924 8.008 1.533 1.00 0.00 C ATOM 0 H ILE A 95 1.235 8.506 0.341 1.00 0.00 H new ATOM 0 HA ILE A 95 0.700 6.347 2.373 1.00 0.00 H new ATOM 0 HB ILE A 95 -0.963 7.374 0.057 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -1.960 6.534 2.785 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -1.083 8.046 2.664 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -2.367 5.354 0.349 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -0.723 4.919 -0.175 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -1.199 4.711 1.527 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -3.516 8.417 2.352 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -2.628 8.814 0.861 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -3.519 7.278 0.984 1.00 0.00 H new ATOM 1371 N LEU A 96 1.951 4.749 0.897 1.00 0.00 N ATOM 1372 CA LEU A 96 2.759 3.853 0.023 1.00 0.00 C ATOM 1373 C LEU A 96 1.982 2.572 -0.272 1.00 0.00 C ATOM 1374 O LEU A 96 1.041 2.233 0.415 1.00 0.00 O ATOM 1375 CB LEU A 96 4.069 3.504 0.735 1.00 0.00 C ATOM 1376 CG LEU A 96 4.654 4.757 1.400 1.00 0.00 C ATOM 1377 CD1 LEU A 96 4.518 5.959 0.463 1.00 0.00 C ATOM 1378 CD2 LEU A 96 3.909 5.045 2.706 1.00 0.00 C ATOM 0 H LEU A 96 1.852 4.440 1.864 1.00 0.00 H new ATOM 0 HA LEU A 96 2.973 4.362 -0.917 1.00 0.00 H new ATOM 0 HB2 LEU A 96 3.891 2.734 1.485 1.00 0.00 H new ATOM 0 HB3 LEU A 96 4.783 3.094 0.021 1.00 0.00 H new ATOM 0 HG LEU A 96 5.709 4.584 1.612 1.00 0.00 H new ATOM 0 HD11 LEU A 96 4.936 6.844 0.943 1.00 0.00 H new ATOM 0 HD12 LEU A 96 5.057 5.761 -0.464 1.00 0.00 H new ATOM 0 HD13 LEU A 96 3.465 6.130 0.241 1.00 0.00 H new ATOM 0 HD21 LEU A 96 4.328 5.935 3.175 1.00 0.00 H new ATOM 0 HD22 LEU A 96 2.853 5.209 2.494 1.00 0.00 H new ATOM 0 HD23 LEU A 96 4.016 4.196 3.381 1.00 0.00 H new ATOM 1390 N VAL A 97 2.369 1.857 -1.294 1.00 0.00 N ATOM 1391 CA VAL A 97 1.653 0.596 -1.637 1.00 0.00 C ATOM 1392 C VAL A 97 2.666 -0.475 -2.044 1.00 0.00 C ATOM 1393 O VAL A 97 3.467 -0.284 -2.937 1.00 0.00 O ATOM 1394 CB VAL A 97 0.690 0.851 -2.800 1.00 0.00 C ATOM 1395 CG1 VAL A 97 0.243 -0.481 -3.412 1.00 0.00 C ATOM 1396 CG2 VAL A 97 -0.539 1.608 -2.289 1.00 0.00 C ATOM 0 H VAL A 97 3.150 2.092 -1.906 1.00 0.00 H new ATOM 0 HA VAL A 97 1.091 0.254 -0.768 1.00 0.00 H new ATOM 0 HB VAL A 97 1.200 1.444 -3.560 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -0.442 -0.290 -4.238 1.00 0.00 H new ATOM 0 HG12 VAL A 97 1.114 -1.023 -3.780 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -0.262 -1.079 -2.653 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -1.225 1.790 -3.117 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -1.041 1.014 -1.526 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -0.227 2.560 -1.860 1.00 0.00 H new ATOM 1406 N GLY A 98 2.618 -1.612 -1.410 1.00 0.00 N ATOM 1407 CA GLY A 98 3.554 -2.710 -1.774 1.00 0.00 C ATOM 1408 C GLY A 98 2.774 -3.741 -2.584 1.00 0.00 C ATOM 1409 O GLY A 98 2.030 -4.535 -2.043 1.00 0.00 O ATOM 0 H GLY A 98 1.969 -1.829 -0.653 1.00 0.00 H new ATOM 0 HA2 GLY A 98 4.390 -2.322 -2.355 1.00 0.00 H new ATOM 0 HA3 GLY A 98 3.973 -3.167 -0.878 1.00 0.00 H new ATOM 1413 N VAL A 99 2.922 -3.726 -3.878 1.00 0.00 N ATOM 1414 CA VAL A 99 2.166 -4.696 -4.720 1.00 0.00 C ATOM 1415 C VAL A 99 3.085 -5.867 -5.081 1.00 0.00 C ATOM 1416 O VAL A 99 4.192 -5.679 -5.542 1.00 0.00 O ATOM 1417 CB VAL A 99 1.654 -4.006 -6.002 1.00 0.00 C ATOM 1418 CG1 VAL A 99 0.125 -4.072 -6.037 1.00 0.00 C ATOM 1419 CG2 VAL A 99 2.083 -2.531 -6.030 1.00 0.00 C ATOM 0 H VAL A 99 3.531 -3.087 -4.389 1.00 0.00 H new ATOM 0 HA VAL A 99 1.305 -5.066 -4.163 1.00 0.00 H new ATOM 0 HB VAL A 99 2.078 -4.520 -6.865 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -0.240 -3.585 -6.942 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -0.194 -5.114 -6.032 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -0.281 -3.564 -5.163 1.00 0.00 H new ATOM 0 HG21 VAL A 99 1.713 -2.062 -6.941 1.00 0.00 H new ATOM 0 HG22 VAL A 99 1.670 -2.016 -5.163 1.00 0.00 H new ATOM 0 HG23 VAL A 99 3.171 -2.468 -6.006 1.00 0.00 H new ATOM 1429 N TYR A 100 2.640 -7.076 -4.857 1.00 0.00 N ATOM 1430 CA TYR A 100 3.495 -8.256 -5.171 1.00 0.00 C ATOM 1431 C TYR A 100 2.620 -9.405 -5.678 1.00 0.00 C ATOM 1432 O TYR A 100 1.442 -9.241 -5.927 1.00 0.00 O ATOM 1433 CB TYR A 100 4.226 -8.707 -3.905 1.00 0.00 C ATOM 1434 CG TYR A 100 3.254 -8.745 -2.749 1.00 0.00 C ATOM 1435 CD1 TYR A 100 2.713 -7.556 -2.242 1.00 0.00 C ATOM 1436 CD2 TYR A 100 2.889 -9.974 -2.185 1.00 0.00 C ATOM 1437 CE1 TYR A 100 1.810 -7.596 -1.172 1.00 0.00 C ATOM 1438 CE2 TYR A 100 1.987 -10.014 -1.115 1.00 0.00 C ATOM 1439 CZ TYR A 100 1.447 -8.826 -0.609 1.00 0.00 C ATOM 1440 OH TYR A 100 0.558 -8.867 0.445 1.00 0.00 O ATOM 0 H TYR A 100 1.722 -7.296 -4.470 1.00 0.00 H new ATOM 0 HA TYR A 100 4.219 -7.981 -5.938 1.00 0.00 H new ATOM 0 HB2 TYR A 100 4.665 -9.693 -4.057 1.00 0.00 H new ATOM 0 HB3 TYR A 100 5.046 -8.024 -3.683 1.00 0.00 H new ATOM 0 HD1 TYR A 100 2.993 -6.608 -2.677 1.00 0.00 H new ATOM 0 HD2 TYR A 100 3.304 -10.891 -2.576 1.00 0.00 H new ATOM 0 HE1 TYR A 100 1.394 -6.679 -0.781 1.00 0.00 H new ATOM 0 HE2 TYR A 100 1.708 -10.962 -0.680 1.00 0.00 H new ATOM 0 HH TYR A 100 0.414 -9.798 0.715 1.00 0.00 H new ATOM 1450 N ASN A 101 3.188 -10.573 -5.824 1.00 0.00 N ATOM 1451 CA ASN A 101 2.393 -11.737 -6.307 1.00 0.00 C ATOM 1452 C ASN A 101 2.425 -12.838 -5.246 1.00 0.00 C ATOM 1453 O ASN A 101 2.693 -12.586 -4.087 1.00 0.00 O ATOM 1454 CB ASN A 101 2.989 -12.278 -7.614 1.00 0.00 C ATOM 1455 CG ASN A 101 3.795 -11.180 -8.315 1.00 0.00 C ATOM 1456 OD1 ASN A 101 3.437 -10.021 -8.264 1.00 0.00 O ATOM 1457 ND2 ASN A 101 4.877 -11.500 -8.972 1.00 0.00 N ATOM 0 H ASN A 101 4.170 -10.770 -5.629 1.00 0.00 H new ATOM 0 HA ASN A 101 1.366 -11.420 -6.488 1.00 0.00 H new ATOM 0 HB2 ASN A 101 3.630 -13.134 -7.404 1.00 0.00 H new ATOM 0 HB3 ASN A 101 2.192 -12.630 -8.269 1.00 0.00 H new ATOM 0 HD21 ASN A 101 5.421 -10.776 -9.442 1.00 0.00 H new ATOM 0 HD22 ASN A 101 5.178 -12.474 -9.015 1.00 0.00 H new ATOM 1464 N GLU A 102 2.158 -14.054 -5.630 1.00 0.00 N ATOM 1465 CA GLU A 102 2.176 -15.166 -4.642 1.00 0.00 C ATOM 1466 C GLU A 102 3.624 -15.543 -4.321 1.00 0.00 C ATOM 1467 O GLU A 102 3.899 -16.208 -3.342 1.00 0.00 O ATOM 1468 CB GLU A 102 1.453 -16.379 -5.228 1.00 0.00 C ATOM 1469 CG GLU A 102 0.767 -17.148 -4.099 1.00 0.00 C ATOM 1470 CD GLU A 102 -0.319 -18.053 -4.684 1.00 0.00 C ATOM 1471 OE1 GLU A 102 -0.095 -18.597 -5.754 1.00 0.00 O ATOM 1472 OE2 GLU A 102 -1.354 -18.187 -4.052 1.00 0.00 O ATOM 0 H GLU A 102 1.928 -14.326 -6.586 1.00 0.00 H new ATOM 0 HA GLU A 102 1.673 -14.847 -3.729 1.00 0.00 H new ATOM 0 HB2 GLU A 102 0.717 -16.058 -5.965 1.00 0.00 H new ATOM 0 HB3 GLU A 102 2.162 -17.025 -5.746 1.00 0.00 H new ATOM 0 HG2 GLU A 102 1.499 -17.745 -3.555 1.00 0.00 H new ATOM 0 HG3 GLU A 102 0.329 -16.451 -3.384 1.00 0.00 H new ATOM 1479 N LYS A 103 4.553 -15.124 -5.138 1.00 0.00 N ATOM 1480 CA LYS A 103 5.980 -15.464 -4.876 1.00 0.00 C ATOM 1481 C LYS A 103 6.450 -14.743 -3.610 1.00 0.00 C ATOM 1482 O LYS A 103 7.199 -15.282 -2.820 1.00 0.00 O ATOM 1483 CB LYS A 103 6.839 -15.028 -6.065 1.00 0.00 C ATOM 1484 CG LYS A 103 7.037 -16.213 -7.014 1.00 0.00 C ATOM 1485 CD LYS A 103 6.300 -15.946 -8.328 1.00 0.00 C ATOM 1486 CE LYS A 103 7.204 -16.318 -9.507 1.00 0.00 C ATOM 1487 NZ LYS A 103 6.488 -17.270 -10.402 1.00 0.00 N ATOM 0 H LYS A 103 4.385 -14.563 -5.973 1.00 0.00 H new ATOM 0 HA LYS A 103 6.078 -16.541 -4.738 1.00 0.00 H new ATOM 0 HB2 LYS A 103 6.358 -14.203 -6.591 1.00 0.00 H new ATOM 0 HB3 LYS A 103 7.805 -14.663 -5.715 1.00 0.00 H new ATOM 0 HG2 LYS A 103 8.099 -16.365 -7.205 1.00 0.00 H new ATOM 0 HG3 LYS A 103 6.662 -17.127 -6.554 1.00 0.00 H new ATOM 0 HD2 LYS A 103 5.379 -16.528 -8.365 1.00 0.00 H new ATOM 0 HD3 LYS A 103 6.016 -14.895 -8.391 1.00 0.00 H new ATOM 0 HE2 LYS A 103 7.484 -15.422 -10.061 1.00 0.00 H new ATOM 0 HE3 LYS A 103 8.127 -16.769 -9.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 7.102 -17.523 -11.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 6.242 -18.129 -9.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 5.619 -16.824 -10.759 1.00 0.00 H new ATOM 1501 N ILE A 104 6.012 -13.530 -3.407 1.00 0.00 N ATOM 1502 CA ILE A 104 6.433 -12.782 -2.189 1.00 0.00 C ATOM 1503 C ILE A 104 5.603 -13.253 -0.995 1.00 0.00 C ATOM 1504 O ILE A 104 4.470 -13.668 -1.142 1.00 0.00 O ATOM 1505 CB ILE A 104 6.204 -11.285 -2.400 1.00 0.00 C ATOM 1506 CG1 ILE A 104 6.728 -10.876 -3.777 1.00 0.00 C ATOM 1507 CG2 ILE A 104 6.948 -10.500 -1.320 1.00 0.00 C ATOM 1508 CD1 ILE A 104 8.248 -11.014 -3.803 1.00 0.00 C ATOM 0 H ILE A 104 5.382 -13.026 -4.031 1.00 0.00 H new ATOM 0 HA ILE A 104 7.491 -12.965 -2.000 1.00 0.00 H new ATOM 0 HB ILE A 104 5.137 -11.069 -2.339 1.00 0.00 H new ATOM 0 HG12 ILE A 104 6.282 -11.503 -4.549 1.00 0.00 H new ATOM 0 HG13 ILE A 104 6.441 -9.848 -3.997 1.00 0.00 H new ATOM 0 HG21 ILE A 104 6.786 -9.433 -1.469 1.00 0.00 H new ATOM 0 HG22 ILE A 104 6.575 -10.790 -0.338 1.00 0.00 H new ATOM 0 HG23 ILE A 104 8.014 -10.717 -1.382 1.00 0.00 H new ATOM 0 HD11 ILE A 104 8.623 -10.723 -4.784 1.00 0.00 H new ATOM 0 HD12 ILE A 104 8.685 -10.368 -3.041 1.00 0.00 H new ATOM 0 HD13 ILE A 104 8.523 -12.050 -3.602 1.00 0.00 H new ATOM 1520 N GLN A 105 6.151 -13.192 0.187 1.00 0.00 N ATOM 1521 CA GLN A 105 5.383 -13.636 1.382 1.00 0.00 C ATOM 1522 C GLN A 105 4.684 -12.424 2.011 1.00 0.00 C ATOM 1523 O GLN A 105 5.263 -11.361 2.106 1.00 0.00 O ATOM 1524 CB GLN A 105 6.337 -14.264 2.398 1.00 0.00 C ATOM 1525 CG GLN A 105 6.257 -15.788 2.294 1.00 0.00 C ATOM 1526 CD GLN A 105 7.069 -16.419 3.426 1.00 0.00 C ATOM 1527 OE1 GLN A 105 8.010 -17.148 3.181 1.00 0.00 O ATOM 1528 NE2 GLN A 105 6.746 -16.165 4.665 1.00 0.00 N ATOM 0 H GLN A 105 7.095 -12.855 0.376 1.00 0.00 H new ATOM 0 HA GLN A 105 4.637 -14.374 1.086 1.00 0.00 H new ATOM 0 HB2 GLN A 105 7.357 -13.929 2.211 1.00 0.00 H new ATOM 0 HB3 GLN A 105 6.075 -13.943 3.406 1.00 0.00 H new ATOM 0 HG2 GLN A 105 5.218 -16.113 2.352 1.00 0.00 H new ATOM 0 HG3 GLN A 105 6.641 -16.118 1.329 1.00 0.00 H new ATOM 0 HE21 GLN A 105 5.956 -15.553 4.871 1.00 0.00 H new ATOM 0 HE22 GLN A 105 7.283 -16.578 5.427 1.00 0.00 H new ATOM 1537 N PRO A 106 3.451 -12.614 2.417 1.00 0.00 N ATOM 1538 CA PRO A 106 2.653 -11.536 3.031 1.00 0.00 C ATOM 1539 C PRO A 106 3.250 -11.116 4.379 1.00 0.00 C ATOM 1540 O PRO A 106 3.029 -10.017 4.849 1.00 0.00 O ATOM 1541 CB PRO A 106 1.261 -12.150 3.237 1.00 0.00 C ATOM 1542 CG PRO A 106 1.327 -13.633 2.785 1.00 0.00 C ATOM 1543 CD PRO A 106 2.754 -13.906 2.289 1.00 0.00 C ATOM 0 HA PRO A 106 2.628 -10.642 2.408 1.00 0.00 H new ATOM 0 HB2 PRO A 106 0.964 -12.082 4.284 1.00 0.00 H new ATOM 0 HB3 PRO A 106 0.514 -11.607 2.658 1.00 0.00 H new ATOM 0 HG2 PRO A 106 1.076 -14.297 3.612 1.00 0.00 H new ATOM 0 HG3 PRO A 106 0.603 -13.824 1.993 1.00 0.00 H new ATOM 0 HD2 PRO A 106 3.239 -14.678 2.886 1.00 0.00 H new ATOM 0 HD3 PRO A 106 2.754 -14.255 1.256 1.00 0.00 H new ATOM 1551 N GLY A 107 3.989 -11.983 5.015 1.00 0.00 N ATOM 1552 CA GLY A 107 4.576 -11.629 6.341 1.00 0.00 C ATOM 1553 C GLY A 107 5.945 -10.965 6.162 1.00 0.00 C ATOM 1554 O GLY A 107 6.236 -9.951 6.765 1.00 0.00 O ATOM 0 H GLY A 107 4.212 -12.919 4.676 1.00 0.00 H new ATOM 0 HA2 GLY A 107 3.905 -10.955 6.874 1.00 0.00 H new ATOM 0 HA3 GLY A 107 4.678 -12.526 6.952 1.00 0.00 H new ATOM 1558 N THR A 108 6.794 -11.530 5.348 1.00 0.00 N ATOM 1559 CA THR A 108 8.146 -10.933 5.145 1.00 0.00 C ATOM 1560 C THR A 108 8.017 -9.577 4.447 1.00 0.00 C ATOM 1561 O THR A 108 8.617 -8.601 4.851 1.00 0.00 O ATOM 1562 CB THR A 108 8.991 -11.876 4.285 1.00 0.00 C ATOM 1563 OG1 THR A 108 9.357 -13.013 5.055 1.00 0.00 O ATOM 1564 CG2 THR A 108 10.252 -11.152 3.810 1.00 0.00 C ATOM 0 H THR A 108 6.611 -12.380 4.814 1.00 0.00 H new ATOM 0 HA THR A 108 8.627 -10.790 6.113 1.00 0.00 H new ATOM 0 HB THR A 108 8.412 -12.192 3.418 1.00 0.00 H new ATOM 0 HG1 THR A 108 9.897 -13.620 4.506 1.00 0.00 H new ATOM 0 HG21 THR A 108 10.850 -11.827 3.198 1.00 0.00 H new ATOM 0 HG22 THR A 108 9.970 -10.280 3.219 1.00 0.00 H new ATOM 0 HG23 THR A 108 10.835 -10.832 4.674 1.00 0.00 H new ATOM 1572 N ALA A 109 7.245 -9.510 3.399 1.00 0.00 N ATOM 1573 CA ALA A 109 7.083 -8.218 2.671 1.00 0.00 C ATOM 1574 C ALA A 109 6.427 -7.179 3.586 1.00 0.00 C ATOM 1575 O ALA A 109 6.391 -6.004 3.278 1.00 0.00 O ATOM 1576 CB ALA A 109 6.207 -8.437 1.436 1.00 0.00 C ATOM 0 H ALA A 109 6.718 -10.294 3.014 1.00 0.00 H new ATOM 0 HA ALA A 109 8.064 -7.854 2.365 1.00 0.00 H new ATOM 0 HB1 ALA A 109 6.088 -7.494 0.903 1.00 0.00 H new ATOM 0 HB2 ALA A 109 6.680 -9.168 0.780 1.00 0.00 H new ATOM 0 HB3 ALA A 109 5.229 -8.806 1.745 1.00 0.00 H new ATOM 1582 N ALA A 110 5.901 -7.599 4.706 1.00 0.00 N ATOM 1583 CA ALA A 110 5.243 -6.630 5.630 1.00 0.00 C ATOM 1584 C ALA A 110 6.266 -6.088 6.634 1.00 0.00 C ATOM 1585 O ALA A 110 6.123 -4.997 7.151 1.00 0.00 O ATOM 1586 CB ALA A 110 4.111 -7.330 6.382 1.00 0.00 C ATOM 0 H ALA A 110 5.899 -8.569 5.020 1.00 0.00 H new ATOM 0 HA ALA A 110 4.838 -5.801 5.050 1.00 0.00 H new ATOM 0 HB1 ALA A 110 3.630 -6.622 7.057 1.00 0.00 H new ATOM 0 HB2 ALA A 110 3.378 -7.706 5.668 1.00 0.00 H new ATOM 0 HB3 ALA A 110 4.517 -8.162 6.958 1.00 0.00 H new ATOM 1592 N ASN A 111 7.294 -6.839 6.919 1.00 0.00 N ATOM 1593 CA ASN A 111 8.317 -6.362 7.894 1.00 0.00 C ATOM 1594 C ASN A 111 9.326 -5.459 7.179 1.00 0.00 C ATOM 1595 O ASN A 111 9.725 -4.431 7.691 1.00 0.00 O ATOM 1596 CB ASN A 111 9.048 -7.563 8.496 1.00 0.00 C ATOM 1597 CG ASN A 111 8.305 -8.042 9.745 1.00 0.00 C ATOM 1598 OD1 ASN A 111 8.835 -7.994 10.837 1.00 0.00 O ATOM 1599 ND2 ASN A 111 7.090 -8.505 9.629 1.00 0.00 N ATOM 0 H ASN A 111 7.470 -7.761 6.520 1.00 0.00 H new ATOM 0 HA ASN A 111 7.825 -5.800 8.687 1.00 0.00 H new ATOM 0 HB2 ASN A 111 9.108 -8.369 7.765 1.00 0.00 H new ATOM 0 HB3 ASN A 111 10.071 -7.288 8.752 1.00 0.00 H new ATOM 0 HD21 ASN A 111 6.586 -8.826 10.455 1.00 0.00 H new ATOM 0 HD22 ASN A 111 6.645 -8.545 8.712 1.00 0.00 H new ATOM 1606 N VAL A 112 9.744 -5.838 6.003 1.00 0.00 N ATOM 1607 CA VAL A 112 10.730 -5.007 5.256 1.00 0.00 C ATOM 1608 C VAL A 112 10.091 -3.681 4.841 1.00 0.00 C ATOM 1609 O VAL A 112 10.732 -2.650 4.837 1.00 0.00 O ATOM 1610 CB VAL A 112 11.187 -5.755 4.015 1.00 0.00 C ATOM 1611 CG1 VAL A 112 12.519 -5.180 3.533 1.00 0.00 C ATOM 1612 CG2 VAL A 112 11.358 -7.240 4.344 1.00 0.00 C ATOM 0 H VAL A 112 9.445 -6.689 5.526 1.00 0.00 H new ATOM 0 HA VAL A 112 11.586 -4.806 5.901 1.00 0.00 H new ATOM 0 HB VAL A 112 10.439 -5.643 3.230 1.00 0.00 H new ATOM 0 HG11 VAL A 112 12.846 -5.717 2.643 1.00 0.00 H new ATOM 0 HG12 VAL A 112 12.394 -4.124 3.294 1.00 0.00 H new ATOM 0 HG13 VAL A 112 13.268 -5.289 4.318 1.00 0.00 H new ATOM 0 HG21 VAL A 112 11.686 -7.775 3.453 1.00 0.00 H new ATOM 0 HG22 VAL A 112 12.104 -7.355 5.131 1.00 0.00 H new ATOM 0 HG23 VAL A 112 10.406 -7.649 4.683 1.00 0.00 H new ATOM 1622 N VAL A 113 8.836 -3.698 4.484 1.00 0.00 N ATOM 1623 CA VAL A 113 8.164 -2.434 4.065 1.00 0.00 C ATOM 1624 C VAL A 113 7.840 -1.591 5.301 1.00 0.00 C ATOM 1625 O VAL A 113 7.750 -0.382 5.231 1.00 0.00 O ATOM 1626 CB VAL A 113 6.867 -2.767 3.322 1.00 0.00 C ATOM 1627 CG1 VAL A 113 6.142 -1.470 2.953 1.00 0.00 C ATOM 1628 CG2 VAL A 113 7.196 -3.547 2.047 1.00 0.00 C ATOM 0 H VAL A 113 8.247 -4.531 4.464 1.00 0.00 H new ATOM 0 HA VAL A 113 8.827 -1.873 3.407 1.00 0.00 H new ATOM 0 HB VAL A 113 6.226 -3.372 3.964 1.00 0.00 H new ATOM 0 HG11 VAL A 113 5.219 -1.707 2.424 1.00 0.00 H new ATOM 0 HG12 VAL A 113 5.908 -0.913 3.860 1.00 0.00 H new ATOM 0 HG13 VAL A 113 6.783 -0.865 2.311 1.00 0.00 H new ATOM 0 HG21 VAL A 113 6.273 -3.784 1.517 1.00 0.00 H new ATOM 0 HG22 VAL A 113 7.837 -2.942 1.406 1.00 0.00 H new ATOM 0 HG23 VAL A 113 7.712 -4.471 2.309 1.00 0.00 H new ATOM 1638 N GLU A 114 7.663 -2.218 6.433 1.00 0.00 N ATOM 1639 CA GLU A 114 7.342 -1.449 7.669 1.00 0.00 C ATOM 1640 C GLU A 114 8.478 -0.472 7.983 1.00 0.00 C ATOM 1641 O GLU A 114 8.253 0.704 8.198 1.00 0.00 O ATOM 1642 CB GLU A 114 7.165 -2.417 8.841 1.00 0.00 C ATOM 1643 CG GLU A 114 5.988 -1.959 9.705 1.00 0.00 C ATOM 1644 CD GLU A 114 6.110 -2.561 11.106 1.00 0.00 C ATOM 1645 OE1 GLU A 114 6.397 -3.742 11.199 1.00 0.00 O ATOM 1646 OE2 GLU A 114 5.914 -1.828 12.062 1.00 0.00 O ATOM 0 H GLU A 114 7.727 -3.229 6.555 1.00 0.00 H new ATOM 0 HA GLU A 114 6.419 -0.890 7.514 1.00 0.00 H new ATOM 0 HB2 GLU A 114 6.987 -3.426 8.470 1.00 0.00 H new ATOM 0 HB3 GLU A 114 8.076 -2.453 9.438 1.00 0.00 H new ATOM 0 HG2 GLU A 114 5.972 -0.871 9.767 1.00 0.00 H new ATOM 0 HG3 GLU A 114 5.048 -2.266 9.248 1.00 0.00 H new ATOM 1653 N LYS A 115 9.696 -0.944 8.015 1.00 0.00 N ATOM 1654 CA LYS A 115 10.839 -0.038 8.321 1.00 0.00 C ATOM 1655 C LYS A 115 11.008 0.978 7.188 1.00 0.00 C ATOM 1656 O LYS A 115 11.360 2.118 7.416 1.00 0.00 O ATOM 1657 CB LYS A 115 12.121 -0.860 8.471 1.00 0.00 C ATOM 1658 CG LYS A 115 12.562 -1.374 7.101 1.00 0.00 C ATOM 1659 CD LYS A 115 13.775 -2.288 7.269 1.00 0.00 C ATOM 1660 CE LYS A 115 14.839 -1.572 8.103 1.00 0.00 C ATOM 1661 NZ LYS A 115 15.253 -0.320 7.407 1.00 0.00 N ATOM 0 H LYS A 115 9.948 -1.917 7.842 1.00 0.00 H new ATOM 0 HA LYS A 115 10.640 0.492 9.253 1.00 0.00 H new ATOM 0 HB2 LYS A 115 12.908 -0.248 8.912 1.00 0.00 H new ATOM 0 HB3 LYS A 115 11.951 -1.697 9.148 1.00 0.00 H new ATOM 0 HG2 LYS A 115 11.746 -1.918 6.624 1.00 0.00 H new ATOM 0 HG3 LYS A 115 12.811 -0.537 6.449 1.00 0.00 H new ATOM 0 HD2 LYS A 115 13.479 -3.217 7.756 1.00 0.00 H new ATOM 0 HD3 LYS A 115 14.181 -2.555 6.293 1.00 0.00 H new ATOM 0 HE2 LYS A 115 14.445 -1.338 9.092 1.00 0.00 H new ATOM 0 HE3 LYS A 115 15.701 -2.223 8.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 16.146 0.024 7.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 15.386 -0.514 6.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 14.516 0.404 7.527 1.00 0.00 H new ATOM 1675 N LEU A 116 10.755 0.577 5.971 1.00 0.00 N ATOM 1676 CA LEU A 116 10.899 1.529 4.830 1.00 0.00 C ATOM 1677 C LEU A 116 10.272 2.868 5.216 1.00 0.00 C ATOM 1678 O LEU A 116 10.819 3.922 4.951 1.00 0.00 O ATOM 1679 CB LEU A 116 10.182 0.965 3.599 1.00 0.00 C ATOM 1680 CG LEU A 116 11.024 1.224 2.348 1.00 0.00 C ATOM 1681 CD1 LEU A 116 11.099 2.728 2.082 1.00 0.00 C ATOM 1682 CD2 LEU A 116 12.436 0.675 2.560 1.00 0.00 C ATOM 0 H LEU A 116 10.456 -0.365 5.717 1.00 0.00 H new ATOM 0 HA LEU A 116 11.955 1.669 4.599 1.00 0.00 H new ATOM 0 HB2 LEU A 116 10.015 -0.105 3.722 1.00 0.00 H new ATOM 0 HB3 LEU A 116 9.202 1.430 3.492 1.00 0.00 H new ATOM 0 HG LEU A 116 10.564 0.727 1.494 1.00 0.00 H new ATOM 0 HD11 LEU A 116 11.699 2.910 1.191 1.00 0.00 H new ATOM 0 HD12 LEU A 116 10.094 3.121 1.929 1.00 0.00 H new ATOM 0 HD13 LEU A 116 11.558 3.226 2.936 1.00 0.00 H new ATOM 0 HD21 LEU A 116 13.036 0.860 1.669 1.00 0.00 H new ATOM 0 HD22 LEU A 116 12.895 1.171 3.415 1.00 0.00 H new ATOM 0 HD23 LEU A 116 12.385 -0.398 2.747 1.00 0.00 H new ATOM 1694 N ALA A 117 9.131 2.837 5.851 1.00 0.00 N ATOM 1695 CA ALA A 117 8.472 4.107 6.263 1.00 0.00 C ATOM 1696 C ALA A 117 9.204 4.677 7.479 1.00 0.00 C ATOM 1697 O ALA A 117 9.366 5.871 7.614 1.00 0.00 O ATOM 1698 CB ALA A 117 7.012 3.833 6.630 1.00 0.00 C ATOM 0 H ALA A 117 8.628 1.986 6.102 1.00 0.00 H new ATOM 0 HA ALA A 117 8.508 4.822 5.441 1.00 0.00 H new ATOM 0 HB1 ALA A 117 6.532 4.764 6.931 1.00 0.00 H new ATOM 0 HB2 ALA A 117 6.491 3.419 5.767 1.00 0.00 H new ATOM 0 HB3 ALA A 117 6.971 3.121 7.454 1.00 0.00 H new ATOM 1704 N ASP A 118 9.647 3.827 8.366 1.00 0.00 N ATOM 1705 CA ASP A 118 10.370 4.319 9.573 1.00 0.00 C ATOM 1706 C ASP A 118 11.429 5.335 9.145 1.00 0.00 C ATOM 1707 O ASP A 118 11.821 6.197 9.905 1.00 0.00 O ATOM 1708 CB ASP A 118 11.051 3.141 10.275 1.00 0.00 C ATOM 1709 CG ASP A 118 10.180 2.665 11.440 1.00 0.00 C ATOM 1710 OD1 ASP A 118 9.492 3.490 12.016 1.00 0.00 O ATOM 1711 OD2 ASP A 118 10.219 1.482 11.735 1.00 0.00 O ATOM 0 H ASP A 118 9.539 2.814 8.307 1.00 0.00 H new ATOM 0 HA ASP A 118 9.664 4.790 10.257 1.00 0.00 H new ATOM 0 HB2 ASP A 118 11.209 2.326 9.569 1.00 0.00 H new ATOM 0 HB3 ASP A 118 12.033 3.441 10.641 1.00 0.00 H new ATOM 1716 N TYR A 119 11.893 5.238 7.930 1.00 0.00 N ATOM 1717 CA TYR A 119 12.924 6.195 7.444 1.00 0.00 C ATOM 1718 C TYR A 119 12.239 7.472 6.956 1.00 0.00 C ATOM 1719 O TYR A 119 12.656 8.572 7.265 1.00 0.00 O ATOM 1720 CB TYR A 119 13.699 5.560 6.286 1.00 0.00 C ATOM 1721 CG TYR A 119 14.995 4.984 6.799 1.00 0.00 C ATOM 1722 CD1 TYR A 119 15.018 4.285 8.011 1.00 0.00 C ATOM 1723 CD2 TYR A 119 16.174 5.146 6.061 1.00 0.00 C ATOM 1724 CE1 TYR A 119 16.221 3.750 8.487 1.00 0.00 C ATOM 1725 CE2 TYR A 119 17.376 4.610 6.536 1.00 0.00 C ATOM 1726 CZ TYR A 119 17.400 3.911 7.749 1.00 0.00 C ATOM 1727 OH TYR A 119 18.586 3.383 8.219 1.00 0.00 O ATOM 0 H TYR A 119 11.601 4.535 7.251 1.00 0.00 H new ATOM 0 HA TYR A 119 13.611 6.436 8.255 1.00 0.00 H new ATOM 0 HB2 TYR A 119 13.100 4.777 5.821 1.00 0.00 H new ATOM 0 HB3 TYR A 119 13.900 6.306 5.517 1.00 0.00 H new ATOM 0 HD1 TYR A 119 14.108 4.158 8.579 1.00 0.00 H new ATOM 0 HD2 TYR A 119 16.156 5.685 5.125 1.00 0.00 H new ATOM 0 HE1 TYR A 119 16.240 3.213 9.424 1.00 0.00 H new ATOM 0 HE2 TYR A 119 18.285 4.735 5.967 1.00 0.00 H new ATOM 0 HH TYR A 119 19.307 3.584 7.586 1.00 0.00 H new ATOM 1737 N LEU A 120 11.193 7.336 6.188 1.00 0.00 N ATOM 1738 CA LEU A 120 10.482 8.532 5.671 1.00 0.00 C ATOM 1739 C LEU A 120 9.416 8.977 6.675 1.00 0.00 C ATOM 1740 O LEU A 120 8.581 9.809 6.379 1.00 0.00 O ATOM 1741 CB LEU A 120 9.812 8.163 4.352 1.00 0.00 C ATOM 1742 CG LEU A 120 10.834 8.245 3.220 1.00 0.00 C ATOM 1743 CD1 LEU A 120 10.873 6.913 2.472 1.00 0.00 C ATOM 1744 CD2 LEU A 120 10.435 9.360 2.252 1.00 0.00 C ATOM 0 H LEU A 120 10.800 6.441 5.896 1.00 0.00 H new ATOM 0 HA LEU A 120 11.190 9.347 5.521 1.00 0.00 H new ATOM 0 HB2 LEU A 120 9.399 7.156 4.411 1.00 0.00 H new ATOM 0 HB3 LEU A 120 8.979 8.838 4.154 1.00 0.00 H new ATOM 0 HG LEU A 120 11.819 8.459 3.635 1.00 0.00 H new ATOM 0 HD11 LEU A 120 11.602 6.971 1.664 1.00 0.00 H new ATOM 0 HD12 LEU A 120 11.157 6.117 3.161 1.00 0.00 H new ATOM 0 HD13 LEU A 120 9.888 6.700 2.057 1.00 0.00 H new ATOM 0 HD21 LEU A 120 11.164 9.419 1.444 1.00 0.00 H new ATOM 0 HD22 LEU A 120 9.450 9.146 1.837 1.00 0.00 H new ATOM 0 HD23 LEU A 120 10.406 10.311 2.784 1.00 0.00 H new ATOM 1756 N ILE A 121 9.435 8.431 7.860 1.00 0.00 N ATOM 1757 CA ILE A 121 8.420 8.823 8.878 1.00 0.00 C ATOM 1758 C ILE A 121 8.959 10.001 9.700 1.00 0.00 C ATOM 1759 O ILE A 121 8.210 10.748 10.297 1.00 0.00 O ATOM 1760 CB ILE A 121 8.113 7.610 9.782 1.00 0.00 C ATOM 1761 CG1 ILE A 121 6.858 6.904 9.257 1.00 0.00 C ATOM 1762 CG2 ILE A 121 7.871 8.051 11.232 1.00 0.00 C ATOM 1763 CD1 ILE A 121 6.895 5.426 9.653 1.00 0.00 C ATOM 0 H ILE A 121 10.110 7.730 8.167 1.00 0.00 H new ATOM 0 HA ILE A 121 7.495 9.135 8.392 1.00 0.00 H new ATOM 0 HB ILE A 121 8.969 6.936 9.764 1.00 0.00 H new ATOM 0 HG12 ILE A 121 5.965 7.378 9.665 1.00 0.00 H new ATOM 0 HG13 ILE A 121 6.802 6.999 8.173 1.00 0.00 H new ATOM 0 HG21 ILE A 121 7.657 7.177 11.847 1.00 0.00 H new ATOM 0 HG22 ILE A 121 8.760 8.554 11.613 1.00 0.00 H new ATOM 0 HG23 ILE A 121 7.024 8.736 11.267 1.00 0.00 H new ATOM 0 HD11 ILE A 121 6.002 4.926 9.278 1.00 0.00 H new ATOM 0 HD12 ILE A 121 7.780 4.956 9.224 1.00 0.00 H new ATOM 0 HD13 ILE A 121 6.930 5.341 10.739 1.00 0.00 H new ATOM 1775 N GLY A 122 10.252 10.171 9.738 1.00 0.00 N ATOM 1776 CA GLY A 122 10.833 11.297 10.524 1.00 0.00 C ATOM 1777 C GLY A 122 10.547 12.623 9.815 1.00 0.00 C ATOM 1778 O GLY A 122 10.143 13.591 10.430 1.00 0.00 O ATOM 0 H GLY A 122 10.931 9.580 9.259 1.00 0.00 H new ATOM 0 HA2 GLY A 122 10.407 11.311 11.527 1.00 0.00 H new ATOM 0 HA3 GLY A 122 11.908 11.158 10.636 1.00 0.00 H new ATOM 1782 N GLN A 123 10.757 12.679 8.528 1.00 0.00 N ATOM 1783 CA GLN A 123 10.500 13.945 7.783 1.00 0.00 C ATOM 1784 C GLN A 123 9.016 14.027 7.415 1.00 0.00 C ATOM 1785 O GLN A 123 8.452 15.097 7.298 1.00 0.00 O ATOM 1786 CB GLN A 123 11.347 13.970 6.508 1.00 0.00 C ATOM 1787 CG GLN A 123 12.822 13.783 6.872 1.00 0.00 C ATOM 1788 CD GLN A 123 13.587 15.081 6.597 1.00 0.00 C ATOM 1789 OE1 GLN A 123 13.644 15.539 5.473 1.00 0.00 O ATOM 1790 NE2 GLN A 123 14.186 15.693 7.582 1.00 0.00 N ATOM 0 H GLN A 123 11.096 11.903 7.960 1.00 0.00 H new ATOM 0 HA GLN A 123 10.766 14.796 8.410 1.00 0.00 H new ATOM 0 HB2 GLN A 123 11.026 13.180 5.830 1.00 0.00 H new ATOM 0 HB3 GLN A 123 11.208 14.916 5.984 1.00 0.00 H new ATOM 0 HG2 GLN A 123 12.916 13.509 7.923 1.00 0.00 H new ATOM 0 HG3 GLN A 123 13.250 12.966 6.290 1.00 0.00 H new ATOM 0 HE21 GLN A 123 14.138 15.309 8.526 1.00 0.00 H new ATOM 0 HE22 GLN A 123 14.702 16.556 7.408 1.00 0.00 H new ATOM 1799 N GLY A 124 8.376 12.902 7.239 1.00 0.00 N ATOM 1800 CA GLY A 124 6.929 12.914 6.884 1.00 0.00 C ATOM 1801 C GLY A 124 6.766 13.162 5.382 1.00 0.00 C ATOM 1802 O GLY A 124 5.990 13.997 4.963 1.00 0.00 O ATOM 0 H GLY A 124 8.794 11.975 7.326 1.00 0.00 H new ATOM 0 HA2 GLY A 124 6.470 11.964 7.157 1.00 0.00 H new ATOM 0 HA3 GLY A 124 6.413 13.691 7.448 1.00 0.00 H new ATOM 1806 N PHE A 125 7.489 12.437 4.571 1.00 0.00 N ATOM 1807 CA PHE A 125 7.379 12.623 3.094 1.00 0.00 C ATOM 1808 C PHE A 125 7.294 14.116 2.762 1.00 0.00 C ATOM 1809 O PHE A 125 6.308 14.514 2.163 1.00 0.00 O ATOM 1810 CB PHE A 125 6.122 11.917 2.580 1.00 0.00 C ATOM 1811 CG PHE A 125 6.442 10.472 2.280 1.00 0.00 C ATOM 1812 CD1 PHE A 125 6.709 9.583 3.329 1.00 0.00 C ATOM 1813 CD2 PHE A 125 6.464 10.017 0.955 1.00 0.00 C ATOM 1814 CE1 PHE A 125 7.000 8.241 3.053 1.00 0.00 C ATOM 1815 CE2 PHE A 125 6.753 8.676 0.681 1.00 0.00 C ATOM 1816 CZ PHE A 125 7.021 7.788 1.729 1.00 0.00 C ATOM 1817 OXT PHE A 125 8.215 14.835 3.112 1.00 0.00 O ATOM 0 H PHE A 125 8.153 11.722 4.868 1.00 0.00 H new ATOM 0 HA PHE A 125 8.260 12.196 2.615 1.00 0.00 H new ATOM 0 HB2 PHE A 125 5.328 11.978 3.324 1.00 0.00 H new ATOM 0 HB3 PHE A 125 5.755 12.413 1.682 1.00 0.00 H new ATOM 0 HD1 PHE A 125 6.690 9.932 4.351 1.00 0.00 H new ATOM 0 HD2 PHE A 125 6.258 10.701 0.145 1.00 0.00 H new ATOM 0 HE1 PHE A 125 7.208 7.556 3.862 1.00 0.00 H new ATOM 0 HE2 PHE A 125 6.769 8.326 -0.340 1.00 0.00 H new ATOM 0 HZ PHE A 125 7.244 6.753 1.516 1.00 0.00 H new TER 1827 PHE A 125