USER MOD reduce.3.24.130724 H: found=0, std=0, add=1497, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1498 hydrogens (22 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 191 GLC O2 : rot 97:sc= 0.23 USER MOD Set 1.2: A 192 BGC O3 : rot 179:sc= 0.00622 USER MOD Set 2.1: A 96 GLN : amide:sc= -1.44 K(o=-1.9,f=0.45) USER MOD Set 2.2: A 100 LYS NZ :NH3+ -150:sc= -0.49 (180deg=0) USER MOD Set 3.1: A 58 GLN : amide:sc= -2.89! C(o=-2.9!,f=-2.4!) USER MOD Set 3.2: A 62 GLN : amide:sc= 0 X(o=-2.9,f=-2.4) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 ASN : amide:sc= -4.22! C(o=-4.2!,f=-6.1!) USER MOD Single : A 20 SER OG : rot 44:sc= 0.0774 USER MOD Single : A 21 HIS : no HD1:sc= -1.4 K(o=-1.4,f=-0.12) USER MOD Single : A 25 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 28 HIS : no HE2:sc= -1.37 K(o=-1.4,f=-2.5!) USER MOD Single : A 29 TYR OH : rot 110:sc= -0.843 USER MOD Single : A 31 LYS NZ :NH3+ -141:sc= 1.04 (180deg=-0.145) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0493) USER MOD Single : A 53 SER OG : rot 127:sc= 1.22 USER MOD Single : A 54 ASN : amide:sc= -0.0266 K(o=-0.027,f=-0.77) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 THR OG1 : rot -70:sc= 1.23 USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= -2.6! K(o=-2.6!,f=0.0035) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 73 TYR OH : rot 130:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ 169:sc= -0.0487 (180deg=-0.227) USER MOD Single : A 83 TYR OH : rot 180:sc= -0.186 USER MOD Single : A 88 LYS NZ :NH3+ -143:sc= 0 (180deg=-0.645) USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= -0.73 USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 ASN : amide:sc= -4.74! C(o=-4.7!,f=-8!) USER MOD Single : A 109 HIS : no HE2:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 LYS NZ :NH3+ -123:sc= -0.245 (180deg=-0.357) USER MOD Single : A 123 HIS : no HD1:sc= 0 X(o=0,f=-0.0036) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 HIS : no HD1:sc=-0.00484 X(o=-0.0048,f=-0.094) USER MOD Single : A 134 SER OG : rot 180:sc= -0.223 USER MOD Single : A 136 LYS NZ :NH3+ 171:sc= -0.0124 (180deg=-0.114) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 147 SER OG : rot 28:sc= 0.0463 USER MOD Single : A 148 THR OG1 : rot 180:sc= 0 USER MOD Single : A 150 THR OG1 : rot 180:sc= 0 USER MOD Single : A 152 LYS NZ :NH3+ -152:sc= -0.583 (180deg=-1.94!) USER MOD Single : A 154 SER OG : rot 20:sc= 0.00117 USER MOD Single : A 159 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 TYR OH : rot 180:sc= 0 USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 164 ASN : amide:sc= -2.11! C(o=-2.1!,f=-3.5!) USER MOD Single : A 166 LYS NZ :NH3+ -130:sc= -0.774 (180deg=-1.42) USER MOD Single : A 168 CYS SG : rot 180:sc= -1.37 USER MOD Single : A 173 MET CE :methyl 154:sc= -0.285 (180deg=-0.985) USER MOD Single : A 174 LYS NZ :NH3+ 180:sc= -0.0312 (180deg=-0.0312) USER MOD Single : A 176 THR OG1 : rot 180:sc= 0 USER MOD Single : A 182 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 184 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 186 HIS : no HD1:sc= -0.651 K(o=-0.65,f=-4.8!) USER MOD Single : A 191 GLC O3 : rot 180:sc= 0 USER MOD Single : A 191 GLC O4 : rot 180:sc= 0 USER MOD Single : A 191 GLC O6 : rot -21:sc= 0.294 USER MOD Single : A 192 BGC O1 : rot 180:sc= 0 USER MOD Single : A 192 BGC O2 : rot 180:sc= 0 USER MOD Single : A 192 BGC O6 : rot -11:sc= 0.324 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 14.761 -21.987 -4.167 1.00 8.93 N ATOM 2 CA GLY A 1 15.681 -22.092 -5.331 1.00 8.42 C ATOM 3 C GLY A 1 17.076 -21.590 -5.014 1.00 7.62 C ATOM 4 O GLY A 1 17.908 -22.341 -4.499 1.00 7.93 O ATOM 0 H1 GLY A 1 13.821 -22.342 -4.434 1.00 8.93 H new ATOM 0 H2 GLY A 1 15.134 -22.553 -3.378 1.00 8.93 H new ATOM 0 H3 GLY A 1 14.684 -20.992 -3.874 1.00 8.93 H new ATOM 0 HA2 GLY A 1 15.737 -23.132 -5.654 1.00 8.42 H new ATOM 0 HA3 GLY A 1 15.273 -21.521 -6.165 1.00 8.42 H new ATOM 10 N ALA A 2 17.331 -20.297 -5.328 1.00 6.82 N ATOM 11 CA ALA A 2 18.648 -19.647 -5.085 1.00 6.18 C ATOM 12 C ALA A 2 18.595 -18.558 -3.962 1.00 5.26 C ATOM 13 O ALA A 2 19.521 -18.473 -3.145 1.00 5.28 O ATOM 14 CB ALA A 2 19.217 -19.058 -6.406 1.00 6.51 C ATOM 0 H ALA A 2 16.640 -19.678 -5.752 1.00 6.82 H new ATOM 0 HA ALA A 2 19.321 -20.425 -4.725 1.00 6.18 H new ATOM 0 HB1 ALA A 2 20.180 -18.587 -6.209 1.00 6.51 H new ATOM 0 HB2 ALA A 2 19.347 -19.858 -7.135 1.00 6.51 H new ATOM 0 HB3 ALA A 2 18.524 -18.316 -6.802 1.00 6.51 H new ATOM 20 N MET A 3 17.505 -17.743 -3.910 1.00 4.80 N ATOM 21 CA MET A 3 17.356 -16.682 -2.896 1.00 4.18 C ATOM 22 C MET A 3 15.961 -16.708 -2.252 1.00 3.48 C ATOM 23 O MET A 3 14.947 -16.467 -2.919 1.00 3.94 O ATOM 24 CB MET A 3 17.606 -15.292 -3.523 1.00 4.96 C ATOM 25 CG MET A 3 19.066 -15.024 -3.929 1.00 5.72 C ATOM 26 SD MET A 3 20.172 -14.907 -2.506 1.00 6.64 S ATOM 27 CE MET A 3 21.745 -14.599 -3.310 1.00 7.64 C ATOM 0 H MET A 3 16.723 -17.807 -4.561 1.00 4.80 H new ATOM 0 HA MET A 3 18.098 -16.870 -2.120 1.00 4.18 H new ATOM 0 HB2 MET A 3 16.973 -15.186 -4.404 1.00 4.96 H new ATOM 0 HB3 MET A 3 17.294 -14.526 -2.813 1.00 4.96 H new ATOM 0 HG2 MET A 3 19.409 -15.823 -4.586 1.00 5.72 H new ATOM 0 HG3 MET A 3 19.116 -14.097 -4.501 1.00 5.72 H new ATOM 0 HE1 MET A 3 22.526 -14.504 -2.556 1.00 7.64 H new ATOM 0 HE2 MET A 3 21.982 -15.429 -3.976 1.00 7.64 H new ATOM 0 HE3 MET A 3 21.684 -13.677 -3.888 1.00 7.64 H new ATOM 37 N SER A 4 15.928 -17.002 -0.941 1.00 2.65 N ATOM 38 CA SER A 4 14.671 -17.062 -0.172 1.00 2.27 C ATOM 39 C SER A 4 14.822 -16.396 1.204 1.00 1.31 C ATOM 40 O SER A 4 15.464 -16.944 2.110 1.00 0.88 O ATOM 41 CB SER A 4 14.206 -18.518 0.001 1.00 2.95 C ATOM 42 OG SER A 4 13.504 -18.978 -1.144 1.00 3.86 O ATOM 0 H SER A 4 16.762 -17.203 -0.389 1.00 2.65 H new ATOM 0 HA SER A 4 13.918 -16.513 -0.738 1.00 2.27 H new ATOM 0 HB2 SER A 4 15.070 -19.158 0.181 1.00 2.95 H new ATOM 0 HB3 SER A 4 13.564 -18.594 0.878 1.00 2.95 H new ATOM 0 HG SER A 4 13.223 -19.906 -1.004 1.00 3.86 H new ATOM 48 N GLY A 5 14.225 -15.203 1.342 1.00 1.11 N ATOM 49 CA GLY A 5 14.287 -14.458 2.597 1.00 0.31 C ATOM 50 C GLY A 5 13.664 -13.072 2.501 1.00 0.28 C ATOM 51 O GLY A 5 14.375 -12.081 2.329 1.00 0.31 O ATOM 0 H GLY A 5 13.698 -14.740 0.602 1.00 1.11 H new ATOM 0 HA2 GLY A 5 13.777 -15.026 3.375 1.00 0.31 H new ATOM 0 HA3 GLY A 5 15.328 -14.361 2.904 1.00 0.31 H new ATOM 55 N LEU A 6 12.316 -13.013 2.611 1.00 0.23 N ATOM 56 CA LEU A 6 11.536 -11.748 2.549 1.00 0.22 C ATOM 57 C LEU A 6 11.368 -11.054 3.943 1.00 0.17 C ATOM 58 O LEU A 6 11.554 -9.829 4.073 1.00 0.16 O ATOM 59 CB LEU A 6 10.171 -12.054 1.882 1.00 0.24 C ATOM 60 CG LEU A 6 9.288 -10.843 1.458 1.00 0.27 C ATOM 61 CD1 LEU A 6 10.026 -9.817 0.595 1.00 0.33 C ATOM 62 CD2 LEU A 6 8.012 -11.272 0.722 1.00 0.35 C ATOM 0 H LEU A 6 11.735 -13.841 2.745 1.00 0.23 H new ATOM 0 HA LEU A 6 12.090 -11.025 1.950 1.00 0.22 H new ATOM 0 HB2 LEU A 6 10.359 -12.660 0.995 1.00 0.24 H new ATOM 0 HB3 LEU A 6 9.591 -12.668 2.571 1.00 0.24 H new ATOM 0 HG LEU A 6 9.022 -10.369 2.403 1.00 0.27 H new ATOM 0 HD11 LEU A 6 9.348 -9.003 0.338 1.00 0.33 H new ATOM 0 HD12 LEU A 6 10.877 -9.420 1.149 1.00 0.33 H new ATOM 0 HD13 LEU A 6 10.379 -10.296 -0.318 1.00 0.33 H new ATOM 0 HD21 LEU A 6 7.434 -10.389 0.450 1.00 0.35 H new ATOM 0 HD22 LEU A 6 8.280 -11.822 -0.180 1.00 0.35 H new ATOM 0 HD23 LEU A 6 7.414 -11.910 1.372 1.00 0.35 H new ATOM 74 N ALA A 7 11.009 -11.872 4.976 1.00 0.17 N ATOM 75 CA ALA A 7 10.850 -11.458 6.418 1.00 0.16 C ATOM 76 C ALA A 7 12.149 -10.864 7.097 1.00 0.15 C ATOM 77 O ALA A 7 12.059 -10.094 8.065 1.00 0.15 O ATOM 78 CB ALA A 7 10.342 -12.676 7.221 1.00 0.20 C ATOM 0 H ALA A 7 10.816 -12.863 4.833 1.00 0.17 H new ATOM 0 HA ALA A 7 10.135 -10.636 6.426 1.00 0.16 H new ATOM 0 HB1 ALA A 7 10.220 -12.397 8.268 1.00 0.20 H new ATOM 0 HB2 ALA A 7 9.383 -13.003 6.819 1.00 0.20 H new ATOM 0 HB3 ALA A 7 11.064 -13.489 7.144 1.00 0.20 H new ATOM 84 N ASP A 8 13.352 -11.214 6.550 1.00 0.16 N ATOM 85 CA ASP A 8 14.664 -10.715 7.041 1.00 0.18 C ATOM 86 C ASP A 8 15.092 -9.349 6.406 1.00 0.17 C ATOM 87 O ASP A 8 16.036 -8.718 6.890 1.00 0.21 O ATOM 88 CB ASP A 8 15.755 -11.766 6.785 1.00 0.21 C ATOM 89 CG ASP A 8 16.085 -12.596 8.021 1.00 0.26 C ATOM 90 OD1 ASP A 8 15.395 -13.610 8.256 1.00 0.31 O ATOM 91 OD2 ASP A 8 17.033 -12.230 8.748 1.00 0.32 O ATOM 0 H ASP A 8 13.433 -11.850 5.757 1.00 0.16 H new ATOM 0 HA ASP A 8 14.544 -10.540 8.110 1.00 0.18 H new ATOM 0 HB2 ASP A 8 15.431 -12.430 5.984 1.00 0.21 H new ATOM 0 HB3 ASP A 8 16.659 -11.266 6.438 1.00 0.21 H new ATOM 96 N LYS A 9 14.388 -8.902 5.326 1.00 0.14 N ATOM 97 CA LYS A 9 14.697 -7.617 4.654 1.00 0.14 C ATOM 98 C LYS A 9 13.658 -6.500 4.954 1.00 0.10 C ATOM 99 O LYS A 9 13.980 -5.328 4.739 1.00 0.10 O ATOM 100 CB LYS A 9 14.871 -7.770 3.114 1.00 0.19 C ATOM 101 CG LYS A 9 15.398 -9.150 2.655 1.00 0.32 C ATOM 102 CD LYS A 9 15.725 -9.214 1.136 1.00 0.92 C ATOM 103 CE LYS A 9 17.121 -8.661 0.789 1.00 1.20 C ATOM 104 NZ LYS A 9 17.393 -8.741 -0.673 1.00 1.73 N ATOM 0 H LYS A 9 13.610 -9.413 4.909 1.00 0.14 H new ATOM 0 HA LYS A 9 15.651 -7.309 5.082 1.00 0.14 H new ATOM 0 HB2 LYS A 9 13.910 -7.586 2.634 1.00 0.19 H new ATOM 0 HB3 LYS A 9 15.557 -6.999 2.762 1.00 0.19 H new ATOM 0 HG2 LYS A 9 16.296 -9.395 3.223 1.00 0.32 H new ATOM 0 HG3 LYS A 9 14.654 -9.911 2.891 1.00 0.32 H new ATOM 0 HD2 LYS A 9 15.658 -10.249 0.800 1.00 0.92 H new ATOM 0 HD3 LYS A 9 14.972 -8.651 0.585 1.00 0.92 H new ATOM 0 HE2 LYS A 9 17.195 -7.624 1.117 1.00 1.20 H new ATOM 0 HE3 LYS A 9 17.881 -9.222 1.333 1.00 1.20 H new ATOM 0 HZ1 LYS A 9 18.340 -8.361 -0.871 1.00 1.73 H new ATOM 0 HZ2 LYS A 9 17.347 -9.733 -0.981 1.00 1.73 H new ATOM 0 HZ3 LYS A 9 16.682 -8.185 -1.189 1.00 1.73 H new ATOM 118 N VAL A 10 12.397 -6.844 5.426 1.00 0.09 N ATOM 119 CA VAL A 10 11.347 -5.822 5.815 1.00 0.07 C ATOM 120 C VAL A 10 11.812 -4.779 6.933 1.00 0.06 C ATOM 121 O VAL A 10 12.430 -5.150 7.939 1.00 0.09 O ATOM 122 CB VAL A 10 9.940 -6.554 6.161 1.00 0.08 C ATOM 123 CG1 VAL A 10 9.890 -7.345 7.513 1.00 0.11 C ATOM 124 CG2 VAL A 10 8.715 -5.594 6.075 1.00 0.10 C ATOM 0 H VAL A 10 12.091 -7.810 5.543 1.00 0.09 H new ATOM 0 HA VAL A 10 11.191 -5.192 4.940 1.00 0.07 H new ATOM 0 HB VAL A 10 9.875 -7.302 5.370 1.00 0.08 H new ATOM 0 HG11 VAL A 10 8.903 -7.791 7.637 1.00 0.11 H new ATOM 0 HG12 VAL A 10 10.645 -8.131 7.503 1.00 0.11 H new ATOM 0 HG13 VAL A 10 10.087 -6.664 8.341 1.00 0.11 H new ATOM 0 HG21 VAL A 10 7.805 -6.143 6.317 1.00 0.10 H new ATOM 0 HG22 VAL A 10 8.844 -4.775 6.783 1.00 0.10 H new ATOM 0 HG23 VAL A 10 8.638 -5.192 5.065 1.00 0.10 H new ATOM 134 N ILE A 11 11.499 -3.491 6.693 1.00 0.06 N ATOM 135 CA ILE A 11 11.835 -2.410 7.658 1.00 0.07 C ATOM 136 C ILE A 11 10.578 -1.669 8.166 1.00 0.07 C ATOM 137 O ILE A 11 10.573 -1.180 9.300 1.00 0.08 O ATOM 138 CB ILE A 11 12.862 -1.337 7.111 1.00 0.10 C ATOM 139 CG1 ILE A 11 12.535 -0.909 5.637 1.00 0.10 C ATOM 140 CG2 ILE A 11 14.334 -1.851 7.261 1.00 0.13 C ATOM 141 CD1 ILE A 11 12.680 0.593 5.349 1.00 0.16 C ATOM 0 H ILE A 11 11.020 -3.170 5.852 1.00 0.06 H new ATOM 0 HA ILE A 11 12.317 -2.941 8.479 1.00 0.07 H new ATOM 0 HB ILE A 11 12.761 -0.439 7.721 1.00 0.10 H new ATOM 0 HG12 ILE A 11 13.191 -1.458 4.961 1.00 0.10 H new ATOM 0 HG13 ILE A 11 11.514 -1.211 5.405 1.00 0.10 H new ATOM 0 HG21 ILE A 11 15.023 -1.098 6.879 1.00 0.13 H new ATOM 0 HG22 ILE A 11 14.548 -2.039 8.313 1.00 0.13 H new ATOM 0 HG23 ILE A 11 14.456 -2.775 6.696 1.00 0.13 H new ATOM 0 HD11 ILE A 11 12.433 0.789 4.306 1.00 0.16 H new ATOM 0 HD12 ILE A 11 12.004 1.154 5.994 1.00 0.16 H new ATOM 0 HD13 ILE A 11 13.707 0.903 5.543 1.00 0.16 H new ATOM 153 N TRP A 12 9.514 -1.596 7.328 1.00 0.06 N ATOM 154 CA TRP A 12 8.279 -0.889 7.698 1.00 0.07 C ATOM 155 C TRP A 12 7.091 -1.354 6.821 1.00 0.08 C ATOM 156 O TRP A 12 7.095 -1.164 5.612 1.00 0.10 O ATOM 157 CB TRP A 12 8.557 0.625 7.554 1.00 0.10 C ATOM 158 CG TRP A 12 7.481 1.544 8.049 1.00 0.09 C ATOM 159 CD1 TRP A 12 7.371 2.132 9.279 1.00 0.19 C ATOM 160 CD2 TRP A 12 6.378 1.997 7.285 1.00 0.22 C ATOM 161 NE1 TRP A 12 6.252 2.927 9.314 1.00 0.26 N ATOM 162 CE2 TRP A 12 5.629 2.854 8.094 1.00 0.30 C ATOM 163 CE3 TRP A 12 5.960 1.747 5.980 1.00 0.35 C ATOM 164 CZ2 TRP A 12 4.480 3.470 7.635 1.00 0.44 C ATOM 165 CZ3 TRP A 12 4.827 2.344 5.517 1.00 0.51 C ATOM 166 CH2 TRP A 12 4.087 3.205 6.339 1.00 0.54 C ATOM 0 H TRP A 12 9.493 -2.017 6.399 1.00 0.06 H new ATOM 0 HA TRP A 12 7.994 -1.112 8.726 1.00 0.07 H new ATOM 0 HB2 TRP A 12 9.478 0.857 8.088 1.00 0.10 H new ATOM 0 HB3 TRP A 12 8.736 0.842 6.501 1.00 0.10 H new ATOM 0 HD1 TRP A 12 8.060 1.992 10.099 1.00 0.19 H new ATOM 0 HE1 TRP A 12 5.937 3.479 10.112 1.00 0.26 H new ATOM 0 HE3 TRP A 12 6.529 1.087 5.342 1.00 0.35 H new ATOM 0 HZ2 TRP A 12 3.910 4.135 8.268 1.00 0.44 H new ATOM 0 HZ3 TRP A 12 4.496 2.152 4.507 1.00 0.51 H new ATOM 0 HH2 TRP A 12 3.193 3.670 5.951 1.00 0.54 H new ATOM 177 N ALA A 13 6.061 -1.986 7.438 1.00 0.09 N ATOM 178 CA ALA A 13 4.851 -2.447 6.693 1.00 0.12 C ATOM 179 C ALA A 13 3.552 -2.066 7.437 1.00 0.16 C ATOM 180 O ALA A 13 3.350 -2.418 8.615 1.00 0.19 O ATOM 181 CB ALA A 13 4.877 -3.974 6.391 1.00 0.14 C ATOM 0 H ALA A 13 6.039 -2.189 8.437 1.00 0.09 H new ATOM 0 HA ALA A 13 4.868 -1.928 5.735 1.00 0.12 H new ATOM 0 HB1 ALA A 13 3.974 -4.253 5.848 1.00 0.14 H new ATOM 0 HB2 ALA A 13 5.752 -4.210 5.785 1.00 0.14 H new ATOM 0 HB3 ALA A 13 4.924 -4.529 7.328 1.00 0.14 H new ATOM 187 N VAL A 14 2.672 -1.301 6.746 1.00 0.20 N ATOM 188 CA VAL A 14 1.372 -0.862 7.341 1.00 0.26 C ATOM 189 C VAL A 14 0.226 -1.149 6.352 1.00 0.27 C ATOM 190 O VAL A 14 0.112 -0.543 5.296 1.00 0.28 O ATOM 191 CB VAL A 14 1.321 0.681 7.844 1.00 0.34 C ATOM 192 CG1 VAL A 14 0.018 1.067 8.590 1.00 0.80 C ATOM 193 CG2 VAL A 14 2.451 1.022 8.810 1.00 1.05 C ATOM 0 H VAL A 14 2.828 -0.976 5.792 1.00 0.20 H new ATOM 0 HA VAL A 14 1.255 -1.449 8.252 1.00 0.26 H new ATOM 0 HB VAL A 14 1.400 1.236 6.909 1.00 0.34 H new ATOM 0 HG11 VAL A 14 0.067 2.114 8.891 1.00 0.80 H new ATOM 0 HG12 VAL A 14 -0.837 0.919 7.930 1.00 0.80 H new ATOM 0 HG13 VAL A 14 -0.094 0.440 9.475 1.00 0.80 H new ATOM 0 HG21 VAL A 14 2.368 2.066 9.114 1.00 1.05 H new ATOM 0 HG22 VAL A 14 2.383 0.382 9.690 1.00 1.05 H new ATOM 0 HG23 VAL A 14 3.411 0.863 8.318 1.00 1.05 H new ATOM 203 N ASN A 15 -0.672 -2.023 6.780 1.00 0.33 N ATOM 204 CA ASN A 15 -1.827 -2.409 5.966 1.00 0.43 C ATOM 205 C ASN A 15 -3.109 -1.916 6.652 1.00 0.46 C ATOM 206 O ASN A 15 -3.758 -2.640 7.404 1.00 0.55 O ATOM 207 CB ASN A 15 -1.816 -3.946 5.704 1.00 0.56 C ATOM 208 CG ASN A 15 -0.533 -4.428 4.986 1.00 1.40 C ATOM 209 OD1 ASN A 15 0.506 -4.626 5.617 1.00 2.05 O ATOM 210 ND2 ASN A 15 -0.611 -4.637 3.688 1.00 2.11 N ATOM 0 H ASN A 15 -0.627 -2.483 7.689 1.00 0.33 H new ATOM 0 HA ASN A 15 -1.781 -1.937 4.984 1.00 0.43 H new ATOM 0 HB2 ASN A 15 -1.913 -4.472 6.654 1.00 0.56 H new ATOM 0 HB3 ASN A 15 -2.685 -4.213 5.102 1.00 0.56 H new ATOM 0 HD21 ASN A 15 0.205 -4.973 3.176 1.00 2.11 H new ATOM 0 HD22 ASN A 15 -1.487 -4.463 3.195 1.00 2.11 H new ATOM 217 N ALA A 16 -3.474 -0.647 6.313 1.00 0.47 N ATOM 218 CA ALA A 16 -4.611 0.094 6.914 1.00 0.54 C ATOM 219 C ALA A 16 -6.032 -0.385 6.489 1.00 0.58 C ATOM 220 O ALA A 16 -6.415 -0.385 5.271 1.00 0.63 O ATOM 221 CB ALA A 16 -4.449 1.604 6.642 1.00 0.59 C ATOM 0 H ALA A 16 -2.977 -0.107 5.605 1.00 0.47 H new ATOM 0 HA ALA A 16 -4.560 -0.121 7.981 1.00 0.54 H new ATOM 0 HB1 ALA A 16 -5.285 2.145 7.084 1.00 0.59 H new ATOM 0 HB2 ALA A 16 -3.516 1.955 7.083 1.00 0.59 H new ATOM 0 HB3 ALA A 16 -4.431 1.780 5.566 1.00 0.59 H new ATOM 227 N GLY A 17 -6.765 -0.795 7.557 1.00 0.58 N ATOM 228 CA GLY A 17 -8.134 -1.292 7.464 1.00 0.61 C ATOM 229 C GLY A 17 -8.556 -2.291 8.554 1.00 0.62 C ATOM 230 O GLY A 17 -9.745 -2.604 8.664 1.00 0.71 O ATOM 0 H GLY A 17 -6.404 -0.784 8.511 1.00 0.58 H new ATOM 0 HA2 GLY A 17 -8.813 -0.440 7.495 1.00 0.61 H new ATOM 0 HA3 GLY A 17 -8.263 -1.767 6.492 1.00 0.61 H new ATOM 234 N GLY A 18 -7.599 -2.778 9.355 1.00 0.72 N ATOM 235 CA GLY A 18 -7.900 -3.756 10.408 1.00 0.73 C ATOM 236 C GLY A 18 -7.019 -3.579 11.637 1.00 0.68 C ATOM 237 O GLY A 18 -7.054 -2.524 12.276 1.00 0.80 O ATOM 0 H GLY A 18 -6.616 -2.513 9.295 1.00 0.72 H new ATOM 0 HA2 GLY A 18 -8.946 -3.662 10.698 1.00 0.73 H new ATOM 0 HA3 GLY A 18 -7.768 -4.763 10.012 1.00 0.73 H new ATOM 241 N GLU A 19 -6.243 -4.622 11.983 1.00 0.59 N ATOM 242 CA GLU A 19 -5.294 -4.580 13.113 1.00 0.60 C ATOM 243 C GLU A 19 -4.367 -5.809 13.091 1.00 0.54 C ATOM 244 O GLU A 19 -4.819 -6.953 13.223 1.00 0.65 O ATOM 245 CB GLU A 19 -6.041 -4.413 14.488 1.00 0.77 C ATOM 246 CG GLU A 19 -5.462 -5.184 15.692 1.00 1.43 C ATOM 247 CD GLU A 19 -6.255 -4.959 16.965 1.00 1.39 C ATOM 248 OE1 GLU A 19 -7.352 -5.543 17.093 1.00 1.50 O ATOM 249 OE2 GLU A 19 -5.781 -4.198 17.833 1.00 1.63 O ATOM 0 H GLU A 19 -6.255 -5.515 11.490 1.00 0.59 H new ATOM 0 HA GLU A 19 -4.663 -3.698 12.998 1.00 0.60 H new ATOM 0 HB2 GLU A 19 -6.057 -3.353 14.739 1.00 0.77 H new ATOM 0 HB3 GLU A 19 -7.077 -4.724 14.352 1.00 0.77 H new ATOM 0 HG2 GLU A 19 -5.445 -6.249 15.462 1.00 1.43 H new ATOM 0 HG3 GLU A 19 -4.429 -4.876 15.853 1.00 1.43 H new ATOM 256 N SER A 20 -3.043 -5.509 12.943 1.00 0.48 N ATOM 257 CA SER A 20 -1.871 -6.465 12.920 1.00 0.45 C ATOM 258 C SER A 20 -2.023 -7.797 12.097 1.00 0.43 C ATOM 259 O SER A 20 -2.638 -8.748 12.596 1.00 0.51 O ATOM 260 CB SER A 20 -1.398 -6.793 14.379 1.00 0.52 C ATOM 261 OG SER A 20 -2.424 -7.346 15.208 1.00 1.00 O ATOM 0 H SER A 20 -2.738 -4.542 12.830 1.00 0.48 H new ATOM 0 HA SER A 20 -1.119 -5.906 12.363 1.00 0.45 H new ATOM 0 HB2 SER A 20 -0.565 -7.494 14.332 1.00 0.52 H new ATOM 0 HB3 SER A 20 -1.021 -5.881 14.842 1.00 0.52 H new ATOM 0 HG SER A 20 -2.919 -8.027 14.706 1.00 1.00 H new ATOM 267 N HIS A 21 -1.470 -7.884 10.859 1.00 0.39 N ATOM 268 CA HIS A 21 -1.594 -9.181 10.103 1.00 0.40 C ATOM 269 C HIS A 21 -0.284 -9.669 9.475 1.00 0.40 C ATOM 270 O HIS A 21 0.435 -8.924 8.815 1.00 0.41 O ATOM 271 CB HIS A 21 -2.714 -9.154 9.026 1.00 0.43 C ATOM 272 CG HIS A 21 -2.868 -10.464 8.231 1.00 0.41 C ATOM 273 ND1 HIS A 21 -3.485 -11.586 8.735 1.00 0.39 N ATOM 274 CD2 HIS A 21 -2.412 -10.850 6.998 1.00 0.45 C ATOM 275 CE1 HIS A 21 -3.383 -12.566 7.845 1.00 0.40 C ATOM 276 NE2 HIS A 21 -2.747 -12.136 6.808 1.00 0.43 N ATOM 0 H HIS A 21 -0.967 -7.137 10.381 1.00 0.39 H new ATOM 0 HA HIS A 21 -1.872 -9.900 10.874 1.00 0.40 H new ATOM 0 HB2 HIS A 21 -3.662 -8.925 9.512 1.00 0.43 H new ATOM 0 HB3 HIS A 21 -2.510 -8.342 8.328 1.00 0.43 H new ATOM 0 HD2 HIS A 21 -1.875 -10.226 6.299 1.00 0.45 H new ATOM 0 HE1 HIS A 21 -3.771 -13.566 7.970 1.00 0.40 H new ATOM 0 HE2 HIS A 21 -2.533 -12.686 5.976 1.00 0.43 H new ATOM 285 N VAL A 22 -0.054 -10.989 9.635 1.00 0.41 N ATOM 286 CA VAL A 22 1.125 -11.675 9.082 1.00 0.43 C ATOM 287 C VAL A 22 0.743 -12.503 7.799 1.00 0.44 C ATOM 288 O VAL A 22 -0.069 -13.435 7.829 1.00 0.48 O ATOM 289 CB VAL A 22 1.960 -12.468 10.234 1.00 0.49 C ATOM 290 CG1 VAL A 22 1.296 -13.751 10.813 1.00 1.38 C ATOM 291 CG2 VAL A 22 3.419 -12.790 9.812 1.00 1.39 C ATOM 0 H VAL A 22 -0.682 -11.606 10.151 1.00 0.41 H new ATOM 0 HA VAL A 22 1.841 -10.937 8.721 1.00 0.43 H new ATOM 0 HB VAL A 22 1.959 -11.740 11.045 1.00 0.49 H new ATOM 0 HG11 VAL A 22 1.947 -14.188 11.570 1.00 1.38 H new ATOM 0 HG12 VAL A 22 0.338 -13.493 11.264 1.00 1.38 H new ATOM 0 HG13 VAL A 22 1.137 -14.472 10.011 1.00 1.38 H new ATOM 0 HG21 VAL A 22 3.924 -13.318 10.621 1.00 1.39 H new ATOM 0 HG22 VAL A 22 3.410 -13.416 8.920 1.00 1.39 H new ATOM 0 HG23 VAL A 22 3.949 -11.862 9.599 1.00 1.39 H new ATOM 301 N ASP A 23 1.371 -12.088 6.684 1.00 0.41 N ATOM 302 CA ASP A 23 1.221 -12.697 5.347 1.00 0.44 C ATOM 303 C ASP A 23 2.164 -13.943 5.215 1.00 0.43 C ATOM 304 O ASP A 23 3.228 -13.982 5.847 1.00 0.41 O ATOM 305 CB ASP A 23 1.474 -11.531 4.307 1.00 0.49 C ATOM 306 CG ASP A 23 1.802 -11.890 2.838 1.00 1.04 C ATOM 307 OD1 ASP A 23 1.177 -12.832 2.305 1.00 1.46 O ATOM 308 OD2 ASP A 23 2.672 -11.225 2.241 1.00 1.85 O ATOM 0 H ASP A 23 2.015 -11.297 6.687 1.00 0.41 H new ATOM 0 HA ASP A 23 0.228 -13.105 5.158 1.00 0.44 H new ATOM 0 HB2 ASP A 23 0.586 -10.899 4.300 1.00 0.49 H new ATOM 0 HB3 ASP A 23 2.295 -10.924 4.688 1.00 0.49 H new ATOM 313 N VAL A 24 1.735 -14.903 4.341 1.00 0.47 N ATOM 314 CA VAL A 24 2.407 -16.259 4.033 1.00 0.50 C ATOM 315 C VAL A 24 3.974 -16.325 3.891 1.00 0.47 C ATOM 316 O VAL A 24 4.563 -17.373 4.176 1.00 0.51 O ATOM 317 CB VAL A 24 1.765 -17.028 2.773 1.00 0.57 C ATOM 318 CG1 VAL A 24 0.459 -17.744 3.151 1.00 0.72 C ATOM 319 CG2 VAL A 24 1.490 -16.138 1.516 1.00 0.58 C ATOM 0 H VAL A 24 0.881 -14.774 3.798 1.00 0.47 H new ATOM 0 HA VAL A 24 2.182 -16.760 4.974 1.00 0.50 H new ATOM 0 HB VAL A 24 2.538 -17.744 2.495 1.00 0.57 H new ATOM 0 HG11 VAL A 24 0.056 -18.252 2.275 1.00 0.72 H new ATOM 0 HG12 VAL A 24 0.659 -18.475 3.934 1.00 0.72 H new ATOM 0 HG13 VAL A 24 -0.265 -17.014 3.513 1.00 0.72 H new ATOM 0 HG21 VAL A 24 1.058 -16.750 0.724 1.00 0.58 H new ATOM 0 HG22 VAL A 24 0.794 -15.341 1.779 1.00 0.58 H new ATOM 0 HG23 VAL A 24 2.426 -15.701 1.167 1.00 0.58 H new ATOM 329 N HIS A 25 4.623 -15.226 3.459 1.00 0.42 N ATOM 330 CA HIS A 25 6.109 -15.154 3.358 1.00 0.40 C ATOM 331 C HIS A 25 6.748 -14.693 4.709 1.00 0.36 C ATOM 332 O HIS A 25 7.903 -15.006 5.009 1.00 0.39 O ATOM 333 CB HIS A 25 6.521 -14.186 2.238 1.00 0.38 C ATOM 334 CG HIS A 25 5.801 -14.399 0.932 1.00 0.42 C ATOM 335 ND1 HIS A 25 6.049 -15.471 0.099 1.00 0.45 N ATOM 336 CD2 HIS A 25 4.825 -13.676 0.329 1.00 0.48 C ATOM 337 CE1 HIS A 25 5.256 -15.397 -0.957 1.00 0.49 C ATOM 338 NE2 HIS A 25 4.506 -14.318 -0.841 1.00 0.51 N ATOM 0 H HIS A 25 4.148 -14.370 3.172 1.00 0.42 H new ATOM 0 HA HIS A 25 6.474 -16.155 3.127 1.00 0.40 H new ATOM 0 HB2 HIS A 25 6.343 -13.165 2.574 1.00 0.38 H new ATOM 0 HB3 HIS A 25 7.593 -14.283 2.067 1.00 0.38 H new ATOM 0 HD2 HIS A 25 4.381 -12.764 0.701 1.00 0.48 H new ATOM 0 HE1 HIS A 25 5.227 -16.101 -1.776 1.00 0.49 H new ATOM 0 HE2 HIS A 25 3.803 -14.011 -1.513 1.00 0.51 H new ATOM 347 N GLY A 26 5.943 -13.944 5.495 1.00 0.34 N ATOM 348 CA GLY A 26 6.315 -13.446 6.813 1.00 0.32 C ATOM 349 C GLY A 26 6.327 -11.925 6.933 1.00 0.27 C ATOM 350 O GLY A 26 7.193 -11.361 7.604 1.00 0.26 O ATOM 0 H GLY A 26 5.001 -13.670 5.214 1.00 0.34 H new ATOM 0 HA2 GLY A 26 5.621 -13.851 7.550 1.00 0.32 H new ATOM 0 HA3 GLY A 26 7.305 -13.826 7.065 1.00 0.32 H new ATOM 354 N ILE A 27 5.343 -11.260 6.289 1.00 0.26 N ATOM 355 CA ILE A 27 5.235 -9.783 6.319 1.00 0.23 C ATOM 356 C ILE A 27 4.030 -9.359 7.234 1.00 0.26 C ATOM 357 O ILE A 27 2.867 -9.591 6.901 1.00 0.33 O ATOM 358 CB ILE A 27 5.197 -9.212 4.820 1.00 0.22 C ATOM 359 CG1 ILE A 27 6.534 -9.505 4.026 1.00 0.18 C ATOM 360 CG2 ILE A 27 4.867 -7.685 4.663 1.00 0.26 C ATOM 361 CD1 ILE A 27 7.885 -9.191 4.685 1.00 0.55 C ATOM 0 H ILE A 27 4.614 -11.720 5.744 1.00 0.26 H new ATOM 0 HA ILE A 27 6.114 -9.328 6.775 1.00 0.23 H new ATOM 0 HB ILE A 27 4.357 -9.762 4.396 1.00 0.22 H new ATOM 0 HG12 ILE A 27 6.535 -10.563 3.766 1.00 0.18 H new ATOM 0 HG13 ILE A 27 6.488 -8.947 3.091 1.00 0.18 H new ATOM 0 HG21 ILE A 27 4.871 -7.419 3.606 1.00 0.26 H new ATOM 0 HG22 ILE A 27 3.883 -7.480 5.086 1.00 0.26 H new ATOM 0 HG23 ILE A 27 5.618 -7.095 5.188 1.00 0.26 H new ATOM 0 HD11 ILE A 27 8.693 -9.453 4.002 1.00 0.55 H new ATOM 0 HD12 ILE A 27 7.938 -8.128 4.918 1.00 0.55 H new ATOM 0 HD13 ILE A 27 7.985 -9.769 5.604 1.00 0.55 H new ATOM 373 N HIS A 28 4.356 -8.693 8.355 1.00 0.25 N ATOM 374 CA HIS A 28 3.362 -8.267 9.360 1.00 0.30 C ATOM 375 C HIS A 28 3.060 -6.743 9.393 1.00 0.28 C ATOM 376 O HIS A 28 3.972 -5.911 9.397 1.00 0.28 O ATOM 377 CB HIS A 28 3.893 -8.697 10.744 1.00 0.40 C ATOM 378 CG HIS A 28 2.862 -9.043 11.789 1.00 0.63 C ATOM 379 ND1 HIS A 28 2.989 -10.131 12.627 1.00 0.93 N ATOM 380 CD2 HIS A 28 1.711 -8.430 12.155 1.00 0.96 C ATOM 381 CE1 HIS A 28 1.964 -10.170 13.459 1.00 1.30 C ATOM 382 NE2 HIS A 28 1.173 -9.150 13.195 1.00 1.34 N ATOM 0 H HIS A 28 5.314 -8.434 8.591 1.00 0.25 H new ATOM 0 HA HIS A 28 2.419 -8.741 9.088 1.00 0.30 H new ATOM 0 HB2 HIS A 28 4.541 -9.563 10.606 1.00 0.40 H new ATOM 0 HB3 HIS A 28 4.516 -7.892 11.134 1.00 0.40 H new ATOM 0 HD1 HIS A 28 3.757 -10.802 12.607 1.00 0.93 H new ATOM 0 HD2 HIS A 28 1.293 -7.539 11.711 1.00 0.96 H new ATOM 0 HE1 HIS A 28 1.802 -10.913 14.226 1.00 1.30 H new ATOM 391 N TYR A 29 1.735 -6.406 9.416 1.00 0.33 N ATOM 392 CA TYR A 29 1.237 -5.015 9.572 1.00 0.38 C ATOM 393 C TYR A 29 1.062 -4.679 11.087 1.00 0.45 C ATOM 394 O TYR A 29 0.678 -5.548 11.876 1.00 0.46 O ATOM 395 CB TYR A 29 -0.081 -4.808 8.731 1.00 0.45 C ATOM 396 CG TYR A 29 -1.274 -4.046 9.389 1.00 0.98 C ATOM 397 CD1 TYR A 29 -1.146 -2.734 9.863 1.00 1.31 C ATOM 398 CD2 TYR A 29 -2.509 -4.672 9.581 1.00 1.34 C ATOM 399 CE1 TYR A 29 -2.214 -2.094 10.482 1.00 1.91 C ATOM 400 CE2 TYR A 29 -3.559 -4.040 10.200 1.00 1.91 C ATOM 401 CZ TYR A 29 -3.399 -2.605 10.488 1.00 2.21 C ATOM 402 OH TYR A 29 -4.470 -2.160 11.273 1.00 2.79 O ATOM 0 H TYR A 29 0.988 -7.095 9.327 1.00 0.33 H new ATOM 0 HA TYR A 29 1.968 -4.311 9.176 1.00 0.38 H new ATOM 0 HB2 TYR A 29 0.189 -4.276 7.818 1.00 0.45 H new ATOM 0 HB3 TYR A 29 -0.441 -5.792 8.432 1.00 0.45 H new ATOM 0 HD1 TYR A 29 -0.207 -2.214 9.746 1.00 1.31 H new ATOM 0 HD2 TYR A 29 -2.641 -5.685 9.231 1.00 1.34 H new ATOM 0 HE1 TYR A 29 -2.048 -1.145 10.970 1.00 1.91 H new ATOM 0 HE2 TYR A 29 -4.461 -4.571 10.464 1.00 1.91 H new ATOM 0 HH TYR A 29 -5.142 -1.736 10.699 1.00 2.79 H new ATOM 412 N ARG A 30 1.296 -3.380 11.432 1.00 0.54 N ATOM 413 CA ARG A 30 1.259 -2.803 12.821 1.00 0.63 C ATOM 414 C ARG A 30 -0.101 -2.900 13.599 1.00 0.91 C ATOM 415 O ARG A 30 -0.464 -3.979 14.059 1.00 1.87 O ATOM 416 CB ARG A 30 1.734 -1.329 12.738 1.00 0.72 C ATOM 417 CG ARG A 30 3.272 -1.091 12.769 1.00 0.68 C ATOM 418 CD ARG A 30 4.075 -2.008 11.822 1.00 0.87 C ATOM 419 NE ARG A 30 4.441 -3.269 12.469 1.00 1.70 N ATOM 420 CZ ARG A 30 5.327 -4.130 11.973 1.00 2.08 C ATOM 421 NH1 ARG A 30 5.934 -3.878 10.820 1.00 1.93 N ATOM 422 NH2 ARG A 30 5.605 -5.248 12.630 1.00 3.00 N ATOM 0 H ARG A 30 1.524 -2.676 10.730 1.00 0.54 H new ATOM 0 HA ARG A 30 1.923 -3.429 13.417 1.00 0.63 H new ATOM 0 HB2 ARG A 30 1.340 -0.895 11.819 1.00 0.72 H new ATOM 0 HB3 ARG A 30 1.287 -0.780 13.567 1.00 0.72 H new ATOM 0 HG2 ARG A 30 3.473 -0.052 12.507 1.00 0.68 H new ATOM 0 HG3 ARG A 30 3.630 -1.237 13.788 1.00 0.68 H new ATOM 0 HD2 ARG A 30 3.485 -2.215 10.929 1.00 0.87 H new ATOM 0 HD3 ARG A 30 4.978 -1.492 11.495 1.00 0.87 H new ATOM 0 HE ARG A 30 3.990 -3.502 13.354 1.00 1.70 H new ATOM 0 HH11 ARG A 30 5.723 -3.021 10.309 1.00 1.93 H new ATOM 0 HH12 ARG A 30 6.612 -4.541 10.445 1.00 1.93 H new ATOM 0 HH21 ARG A 30 5.140 -5.448 13.515 1.00 3.00 H new ATOM 0 HH22 ARG A 30 6.284 -5.908 12.250 1.00 3.00 H new ATOM 436 N LYS A 31 -0.807 -1.765 13.771 1.00 0.57 N ATOM 437 CA LYS A 31 -2.078 -1.683 14.517 1.00 0.59 C ATOM 438 C LYS A 31 -2.725 -0.264 14.463 1.00 0.64 C ATOM 439 O LYS A 31 -2.713 0.472 15.455 1.00 0.79 O ATOM 440 CB LYS A 31 -1.822 -2.096 15.990 1.00 0.73 C ATOM 441 CG LYS A 31 -3.092 -2.358 16.866 1.00 1.15 C ATOM 442 CD LYS A 31 -3.323 -1.254 17.929 1.00 1.44 C ATOM 443 CE LYS A 31 -4.617 -1.471 18.734 1.00 1.70 C ATOM 444 NZ LYS A 31 -5.825 -1.434 17.863 1.00 2.30 N ATOM 0 H LYS A 31 -0.506 -0.868 13.391 1.00 0.57 H new ATOM 0 HA LYS A 31 -2.786 -2.363 14.043 1.00 0.59 H new ATOM 0 HB2 LYS A 31 -1.213 -3.000 15.991 1.00 0.73 H new ATOM 0 HB3 LYS A 31 -1.232 -1.313 16.467 1.00 0.73 H new ATOM 0 HG2 LYS A 31 -3.967 -2.423 16.220 1.00 1.15 H new ATOM 0 HG3 LYS A 31 -2.992 -3.322 17.365 1.00 1.15 H new ATOM 0 HD2 LYS A 31 -2.474 -1.229 18.612 1.00 1.44 H new ATOM 0 HD3 LYS A 31 -3.364 -0.283 17.436 1.00 1.44 H new ATOM 0 HE2 LYS A 31 -4.569 -2.431 19.247 1.00 1.70 H new ATOM 0 HE3 LYS A 31 -4.700 -0.703 19.503 1.00 1.70 H new ATOM 0 HZ1 LYS A 31 -6.595 -0.940 18.358 1.00 2.30 H new ATOM 0 HZ2 LYS A 31 -5.602 -0.931 16.981 1.00 2.30 H new ATOM 0 HZ3 LYS A 31 -6.123 -2.405 17.641 1.00 2.30 H new ATOM 458 N ASP A 32 -3.267 0.122 13.271 1.00 0.61 N ATOM 459 CA ASP A 32 -4.028 1.414 13.027 1.00 0.72 C ATOM 460 C ASP A 32 -3.245 2.779 13.154 1.00 0.75 C ATOM 461 O ASP A 32 -3.747 3.702 13.805 1.00 1.00 O ATOM 462 CB ASP A 32 -5.291 1.478 13.938 1.00 0.86 C ATOM 463 CG ASP A 32 -6.432 0.566 13.487 1.00 0.95 C ATOM 464 OD1 ASP A 32 -7.053 0.867 12.445 1.00 1.17 O ATOM 465 OD2 ASP A 32 -6.702 -0.439 14.174 1.00 1.01 O ATOM 0 H ASP A 32 -3.194 -0.454 12.432 1.00 0.61 H new ATOM 0 HA ASP A 32 -4.268 1.343 11.966 1.00 0.72 H new ATOM 0 HB2 ASP A 32 -5.006 1.210 14.955 1.00 0.86 H new ATOM 0 HB3 ASP A 32 -5.652 2.506 13.969 1.00 0.86 H new ATOM 470 N PRO A 33 -2.025 2.954 12.546 1.00 0.59 N ATOM 471 CA PRO A 33 -1.275 4.222 12.591 1.00 0.66 C ATOM 472 C PRO A 33 -1.274 5.018 11.249 1.00 0.83 C ATOM 473 O PRO A 33 -1.534 4.467 10.176 1.00 1.45 O ATOM 474 CB PRO A 33 0.136 3.703 12.903 1.00 0.59 C ATOM 475 CG PRO A 33 0.230 2.395 12.133 1.00 0.57 C ATOM 476 CD PRO A 33 -1.221 1.959 11.833 1.00 0.49 C ATOM 0 HA PRO A 33 -1.699 4.932 13.301 1.00 0.66 H new ATOM 0 HB2 PRO A 33 0.901 4.410 12.582 1.00 0.59 H new ATOM 0 HB3 PRO A 33 0.276 3.547 13.973 1.00 0.59 H new ATOM 0 HG2 PRO A 33 0.794 2.528 11.210 1.00 0.57 H new ATOM 0 HG3 PRO A 33 0.750 1.637 12.718 1.00 0.57 H new ATOM 0 HD2 PRO A 33 -1.430 1.965 10.763 1.00 0.49 H new ATOM 0 HD3 PRO A 33 -1.420 0.949 12.191 1.00 0.49 H new ATOM 484 N LEU A 34 -0.974 6.310 11.360 1.00 0.72 N ATOM 485 CA LEU A 34 -0.884 7.253 10.218 1.00 0.91 C ATOM 486 C LEU A 34 -0.173 8.550 10.658 1.00 1.43 C ATOM 487 O LEU A 34 1.046 8.666 10.503 1.00 1.91 O ATOM 488 CB LEU A 34 -2.282 7.578 9.602 1.00 1.02 C ATOM 489 CG LEU A 34 -2.707 6.776 8.332 1.00 0.88 C ATOM 490 CD1 LEU A 34 -4.148 6.315 8.414 1.00 1.67 C ATOM 491 CD2 LEU A 34 -2.545 7.578 7.058 1.00 1.33 C ATOM 0 H LEU A 34 -0.781 6.752 12.259 1.00 0.72 H new ATOM 0 HA LEU A 34 -0.299 6.765 9.438 1.00 0.91 H new ATOM 0 HB2 LEU A 34 -3.036 7.416 10.372 1.00 1.02 H new ATOM 0 HB3 LEU A 34 -2.303 8.639 9.354 1.00 1.02 H new ATOM 0 HG LEU A 34 -2.040 5.914 8.301 1.00 0.88 H new ATOM 0 HD11 LEU A 34 -4.405 5.761 7.511 1.00 1.67 H new ATOM 0 HD12 LEU A 34 -4.275 5.670 9.284 1.00 1.67 H new ATOM 0 HD13 LEU A 34 -4.803 7.182 8.506 1.00 1.67 H new ATOM 0 HD21 LEU A 34 -2.855 6.973 6.206 1.00 1.33 H new ATOM 0 HD22 LEU A 34 -3.163 8.474 7.111 1.00 1.33 H new ATOM 0 HD23 LEU A 34 -1.500 7.865 6.939 1.00 1.33 H new ATOM 503 N GLU A 35 -0.938 9.523 11.207 1.00 1.77 N ATOM 504 CA GLU A 35 -0.369 10.812 11.681 1.00 2.54 C ATOM 505 C GLU A 35 -1.029 11.305 12.989 1.00 2.66 C ATOM 506 O GLU A 35 -1.624 12.391 13.023 1.00 3.33 O ATOM 507 CB GLU A 35 -0.514 11.911 10.600 1.00 3.34 C ATOM 508 CG GLU A 35 0.282 11.667 9.320 1.00 3.49 C ATOM 509 CD GLU A 35 0.218 12.841 8.360 1.00 4.38 C ATOM 510 OE1 GLU A 35 -0.737 12.900 7.557 1.00 4.84 O ATOM 511 OE2 GLU A 35 1.121 13.703 8.413 1.00 4.80 O ATOM 0 H GLU A 35 -1.947 9.443 11.333 1.00 1.77 H new ATOM 0 HA GLU A 35 0.686 10.623 11.880 1.00 2.54 H new ATOM 0 HB2 GLU A 35 -1.568 12.008 10.341 1.00 3.34 H new ATOM 0 HB3 GLU A 35 -0.202 12.864 11.028 1.00 3.34 H new ATOM 0 HG2 GLU A 35 1.323 11.468 9.576 1.00 3.49 H new ATOM 0 HG3 GLU A 35 -0.100 10.775 8.823 1.00 3.49 H new ATOM 518 N GLY A 36 -0.928 10.504 14.074 1.00 2.22 N ATOM 519 CA GLY A 36 -1.522 10.891 15.373 1.00 2.37 C ATOM 520 C GLY A 36 -2.920 10.300 15.680 1.00 1.99 C ATOM 521 O GLY A 36 -3.482 10.580 16.743 1.00 2.30 O ATOM 0 H GLY A 36 -0.450 9.603 14.078 1.00 2.22 H new ATOM 0 HA2 GLY A 36 -0.839 10.589 16.167 1.00 2.37 H new ATOM 0 HA3 GLY A 36 -1.593 11.978 15.409 1.00 2.37 H new ATOM 525 N ARG A 37 -3.475 9.484 14.753 1.00 1.73 N ATOM 526 CA ARG A 37 -4.807 8.880 14.905 1.00 2.21 C ATOM 527 C ARG A 37 -4.721 7.361 15.150 1.00 2.05 C ATOM 528 O ARG A 37 -4.742 6.551 14.219 1.00 2.64 O ATOM 529 CB ARG A 37 -5.708 9.180 13.666 1.00 3.16 C ATOM 530 CG ARG A 37 -5.004 9.053 12.287 1.00 3.40 C ATOM 531 CD ARG A 37 -4.405 10.388 11.800 1.00 3.20 C ATOM 532 NE ARG A 37 -5.447 11.343 11.423 1.00 3.69 N ATOM 533 CZ ARG A 37 -5.206 12.605 11.079 1.00 3.94 C ATOM 534 NH1 ARG A 37 -3.966 13.074 11.087 1.00 3.94 N ATOM 535 NH2 ARG A 37 -6.208 13.400 10.733 1.00 4.50 N ATOM 0 H ARG A 37 -3.008 9.230 13.883 1.00 1.73 H new ATOM 0 HA ARG A 37 -5.265 9.335 15.783 1.00 2.21 H new ATOM 0 HB2 ARG A 37 -6.560 8.501 13.684 1.00 3.16 H new ATOM 0 HB3 ARG A 37 -6.104 10.191 13.762 1.00 3.16 H new ATOM 0 HG2 ARG A 37 -4.212 8.307 12.355 1.00 3.40 H new ATOM 0 HG3 ARG A 37 -5.720 8.690 11.550 1.00 3.40 H new ATOM 0 HD2 ARG A 37 -3.785 10.817 12.587 1.00 3.20 H new ATOM 0 HD3 ARG A 37 -3.753 10.204 10.946 1.00 3.20 H new ATOM 0 HE ARG A 37 -6.415 11.022 11.424 1.00 3.69 H new ATOM 0 HH11 ARG A 37 -3.193 12.466 11.358 1.00 3.94 H new ATOM 0 HH12 ARG A 37 -3.785 14.042 10.823 1.00 3.94 H new ATOM 0 HH21 ARG A 37 -7.164 13.044 10.731 1.00 4.50 H new ATOM 0 HH22 ARG A 37 -6.023 14.368 10.469 1.00 4.50 H new ATOM 549 N VAL A 38 -4.593 7.012 16.434 1.00 1.67 N ATOM 550 CA VAL A 38 -4.522 5.593 16.895 1.00 1.61 C ATOM 551 C VAL A 38 -5.786 5.213 17.718 1.00 1.73 C ATOM 552 O VAL A 38 -6.040 5.783 18.787 1.00 2.44 O ATOM 553 CB VAL A 38 -3.195 5.194 17.717 1.00 2.08 C ATOM 554 CG1 VAL A 38 -2.092 4.673 16.775 1.00 2.70 C ATOM 555 CG2 VAL A 38 -2.586 6.320 18.617 1.00 2.63 C ATOM 0 H VAL A 38 -4.535 7.691 17.193 1.00 1.67 H new ATOM 0 HA VAL A 38 -4.476 5.015 15.972 1.00 1.61 H new ATOM 0 HB VAL A 38 -3.544 4.414 18.394 1.00 2.08 H new ATOM 0 HG11 VAL A 38 -1.209 4.412 17.358 1.00 2.70 H new ATOM 0 HG12 VAL A 38 -2.452 3.790 16.246 1.00 2.70 H new ATOM 0 HG13 VAL A 38 -1.834 5.448 16.053 1.00 2.70 H new ATOM 0 HG21 VAL A 38 -1.698 5.941 19.123 1.00 2.63 H new ATOM 0 HG22 VAL A 38 -2.314 7.174 17.997 1.00 2.63 H new ATOM 0 HG23 VAL A 38 -3.321 6.630 19.359 1.00 2.63 H new ATOM 565 N GLY A 39 -6.560 4.246 17.201 1.00 1.64 N ATOM 566 CA GLY A 39 -7.780 3.820 17.880 1.00 1.95 C ATOM 567 C GLY A 39 -8.328 2.486 17.391 1.00 1.52 C ATOM 568 O GLY A 39 -7.801 1.426 17.741 1.00 1.67 O ATOM 0 H GLY A 39 -6.362 3.755 16.329 1.00 1.64 H new ATOM 0 HA2 GLY A 39 -7.583 3.750 18.950 1.00 1.95 H new ATOM 0 HA3 GLY A 39 -8.544 4.586 17.747 1.00 1.95 H new ATOM 572 N ARG A 40 -9.402 2.548 16.579 1.00 1.49 N ATOM 573 CA ARG A 40 -10.068 1.337 16.045 1.00 1.54 C ATOM 574 C ARG A 40 -10.086 1.273 14.492 1.00 1.40 C ATOM 575 O ARG A 40 -9.639 2.193 13.793 1.00 1.40 O ATOM 576 CB ARG A 40 -11.521 1.266 16.576 1.00 2.19 C ATOM 577 CG ARG A 40 -11.717 0.486 17.904 1.00 2.54 C ATOM 578 CD ARG A 40 -11.071 1.177 19.115 1.00 3.29 C ATOM 579 NE ARG A 40 -11.256 0.401 20.339 1.00 3.83 N ATOM 580 CZ ARG A 40 -10.769 0.760 21.524 1.00 4.62 C ATOM 581 NH1 ARG A 40 -10.071 1.883 21.648 1.00 4.94 N ATOM 582 NH2 ARG A 40 -10.979 -0.004 22.587 1.00 5.34 N ATOM 0 H ARG A 40 -9.829 3.424 16.277 1.00 1.49 H new ATOM 0 HA ARG A 40 -9.484 0.484 16.390 1.00 1.54 H new ATOM 0 HB2 ARG A 40 -11.887 2.283 16.717 1.00 2.19 H new ATOM 0 HB3 ARG A 40 -12.146 0.806 15.810 1.00 2.19 H new ATOM 0 HG2 ARG A 40 -12.784 0.363 18.091 1.00 2.54 H new ATOM 0 HG3 ARG A 40 -11.295 -0.513 17.796 1.00 2.54 H new ATOM 0 HD2 ARG A 40 -10.006 1.317 18.930 1.00 3.29 H new ATOM 0 HD3 ARG A 40 -11.505 2.169 19.243 1.00 3.29 H new ATOM 0 HE ARG A 40 -11.790 -0.466 20.282 1.00 3.83 H new ATOM 0 HH11 ARG A 40 -9.907 2.474 20.833 1.00 4.94 H new ATOM 0 HH12 ARG A 40 -9.699 2.155 22.558 1.00 4.94 H new ATOM 0 HH21 ARG A 40 -11.514 -0.868 22.497 1.00 5.34 H new ATOM 0 HH22 ARG A 40 -10.605 0.272 23.495 1.00 5.34 H new ATOM 596 N ALA A 41 -10.634 0.143 13.972 1.00 1.35 N ATOM 597 CA ALA A 41 -10.755 -0.142 12.516 1.00 1.29 C ATOM 598 C ALA A 41 -12.167 0.204 11.952 1.00 1.31 C ATOM 599 O ALA A 41 -13.187 0.095 12.656 1.00 1.64 O ATOM 600 CB ALA A 41 -10.432 -1.633 12.266 1.00 1.35 C ATOM 0 H ALA A 41 -11.008 -0.604 14.558 1.00 1.35 H new ATOM 0 HA ALA A 41 -10.044 0.495 11.990 1.00 1.29 H new ATOM 0 HB1 ALA A 41 -10.518 -1.850 11.201 1.00 1.35 H new ATOM 0 HB2 ALA A 41 -9.416 -1.846 12.599 1.00 1.35 H new ATOM 0 HB3 ALA A 41 -11.134 -2.255 12.821 1.00 1.35 H new ATOM 606 N SER A 42 -12.212 0.636 10.670 1.00 1.13 N ATOM 607 CA SER A 42 -13.475 0.993 9.999 1.00 1.15 C ATOM 608 C SER A 42 -13.801 0.021 8.845 1.00 1.10 C ATOM 609 O SER A 42 -13.504 0.287 7.676 1.00 1.57 O ATOM 610 CB SER A 42 -13.417 2.441 9.486 1.00 1.23 C ATOM 611 OG SER A 42 -13.620 3.373 10.538 1.00 1.43 O ATOM 0 H SER A 42 -11.385 0.744 10.083 1.00 1.13 H new ATOM 0 HA SER A 42 -14.276 0.911 10.733 1.00 1.15 H new ATOM 0 HB2 SER A 42 -12.450 2.624 9.018 1.00 1.23 H new ATOM 0 HB3 SER A 42 -14.176 2.587 8.717 1.00 1.23 H new ATOM 0 HG SER A 42 -13.576 4.284 10.181 1.00 1.43 H new ATOM 617 N ASP A 43 -14.438 -1.113 9.204 1.00 0.99 N ATOM 618 CA ASP A 43 -14.833 -2.163 8.239 1.00 0.98 C ATOM 619 C ASP A 43 -16.358 -2.125 7.961 1.00 1.13 C ATOM 620 O ASP A 43 -17.137 -2.871 8.567 1.00 1.62 O ATOM 621 CB ASP A 43 -14.417 -3.547 8.770 1.00 1.01 C ATOM 622 CG ASP A 43 -13.211 -4.119 8.039 1.00 1.65 C ATOM 623 OD1 ASP A 43 -13.349 -4.462 6.846 1.00 2.33 O ATOM 624 OD2 ASP A 43 -12.131 -4.218 8.659 1.00 1.80 O ATOM 0 H ASP A 43 -14.693 -1.327 10.168 1.00 0.99 H new ATOM 0 HA ASP A 43 -14.319 -1.973 7.297 1.00 0.98 H new ATOM 0 HB2 ASP A 43 -14.189 -3.470 9.833 1.00 1.01 H new ATOM 0 HB3 ASP A 43 -15.256 -4.236 8.673 1.00 1.01 H new ATOM 629 N TYR A 44 -16.767 -1.224 7.035 1.00 1.26 N ATOM 630 CA TYR A 44 -18.185 -1.065 6.639 1.00 1.48 C ATOM 631 C TYR A 44 -18.423 -1.688 5.248 1.00 1.68 C ATOM 632 O TYR A 44 -18.446 -1.003 4.218 1.00 2.40 O ATOM 633 CB TYR A 44 -18.578 0.426 6.647 1.00 1.58 C ATOM 634 CG TYR A 44 -19.863 0.739 7.430 1.00 1.67 C ATOM 635 CD1 TYR A 44 -21.125 0.330 6.974 1.00 1.93 C ATOM 636 CD2 TYR A 44 -19.808 1.451 8.631 1.00 2.02 C ATOM 637 CE1 TYR A 44 -22.274 0.624 7.693 1.00 2.32 C ATOM 638 CE2 TYR A 44 -20.959 1.741 9.348 1.00 2.50 C ATOM 639 CZ TYR A 44 -22.217 1.288 8.834 1.00 2.56 C ATOM 640 OH TYR A 44 -23.324 1.617 9.586 1.00 3.16 O ATOM 0 H TYR A 44 -16.130 -0.594 6.547 1.00 1.26 H new ATOM 0 HA TYR A 44 -18.814 -1.587 7.360 1.00 1.48 H new ATOM 0 HB2 TYR A 44 -17.758 1.003 7.073 1.00 1.58 H new ATOM 0 HB3 TYR A 44 -18.703 0.762 5.618 1.00 1.58 H new ATOM 0 HD1 TYR A 44 -21.203 -0.222 6.049 1.00 1.93 H new ATOM 0 HD2 TYR A 44 -18.851 1.782 9.008 1.00 2.02 H new ATOM 0 HE1 TYR A 44 -23.233 0.304 7.313 1.00 2.32 H new ATOM 0 HE2 TYR A 44 -20.908 2.296 10.273 1.00 2.50 H new ATOM 0 HH TYR A 44 -23.042 2.105 10.388 1.00 3.16 H new ATOM 650 N GLY A 45 -18.588 -3.016 5.270 1.00 1.41 N ATOM 651 CA GLY A 45 -18.764 -3.820 4.066 1.00 1.52 C ATOM 652 C GLY A 45 -17.726 -4.939 4.029 1.00 1.29 C ATOM 653 O GLY A 45 -16.806 -4.914 3.207 1.00 1.22 O ATOM 0 H GLY A 45 -18.602 -3.561 6.132 1.00 1.41 H new ATOM 0 HA2 GLY A 45 -19.768 -4.243 4.045 1.00 1.52 H new ATOM 0 HA3 GLY A 45 -18.665 -3.191 3.181 1.00 1.52 H new ATOM 657 N MET A 46 -17.890 -5.926 4.939 1.00 1.26 N ATOM 658 CA MET A 46 -16.947 -7.060 5.093 1.00 1.14 C ATOM 659 C MET A 46 -17.286 -8.335 4.263 1.00 1.13 C ATOM 660 O MET A 46 -16.554 -9.327 4.336 1.00 1.13 O ATOM 661 CB MET A 46 -16.859 -7.430 6.586 1.00 1.28 C ATOM 662 CG MET A 46 -15.432 -7.518 7.143 1.00 1.04 C ATOM 663 SD MET A 46 -15.377 -8.240 8.797 1.00 1.58 S ATOM 664 CE MET A 46 -13.625 -8.138 9.167 1.00 1.67 C ATOM 0 H MET A 46 -18.677 -5.960 5.586 1.00 1.26 H new ATOM 0 HA MET A 46 -15.995 -6.709 4.695 1.00 1.14 H new ATOM 0 HB2 MET A 46 -17.414 -6.690 7.163 1.00 1.28 H new ATOM 0 HB3 MET A 46 -17.353 -8.389 6.738 1.00 1.28 H new ATOM 0 HG2 MET A 46 -14.819 -8.116 6.469 1.00 1.04 H new ATOM 0 HG3 MET A 46 -14.995 -6.520 7.171 1.00 1.04 H new ATOM 0 HE1 MET A 46 -13.438 -8.548 10.160 1.00 1.67 H new ATOM 0 HE2 MET A 46 -13.063 -8.708 8.427 1.00 1.67 H new ATOM 0 HE3 MET A 46 -13.307 -7.096 9.139 1.00 1.67 H new ATOM 674 N LYS A 47 -18.382 -8.300 3.476 1.00 1.20 N ATOM 675 CA LYS A 47 -18.789 -9.435 2.636 1.00 1.24 C ATOM 676 C LYS A 47 -18.644 -9.088 1.131 1.00 1.33 C ATOM 677 O LYS A 47 -19.622 -8.952 0.390 1.00 1.68 O ATOM 678 CB LYS A 47 -20.230 -9.831 3.000 1.00 1.34 C ATOM 679 CG LYS A 47 -20.692 -11.222 2.461 1.00 2.03 C ATOM 680 CD LYS A 47 -22.133 -11.216 1.884 1.00 2.90 C ATOM 681 CE LYS A 47 -22.192 -10.667 0.443 1.00 3.65 C ATOM 682 NZ LYS A 47 -21.616 -11.631 -0.535 1.00 4.18 N ATOM 0 H LYS A 47 -19.000 -7.492 3.408 1.00 1.20 H new ATOM 0 HA LYS A 47 -18.135 -10.287 2.823 1.00 1.24 H new ATOM 0 HB2 LYS A 47 -20.327 -9.829 4.086 1.00 1.34 H new ATOM 0 HB3 LYS A 47 -20.908 -9.067 2.618 1.00 1.34 H new ATOM 0 HG2 LYS A 47 -20.000 -11.550 1.685 1.00 2.03 H new ATOM 0 HG3 LYS A 47 -20.636 -11.952 3.268 1.00 2.03 H new ATOM 0 HD2 LYS A 47 -22.531 -12.231 1.899 1.00 2.90 H new ATOM 0 HD3 LYS A 47 -22.775 -10.612 2.526 1.00 2.90 H new ATOM 0 HE2 LYS A 47 -23.227 -10.453 0.177 1.00 3.65 H new ATOM 0 HE3 LYS A 47 -21.647 -9.724 0.390 1.00 3.65 H new ATOM 0 HZ1 LYS A 47 -21.808 -11.301 -1.502 1.00 4.18 H new ATOM 0 HZ2 LYS A 47 -20.588 -11.700 -0.390 1.00 4.18 H new ATOM 0 HZ3 LYS A 47 -22.049 -12.566 -0.396 1.00 4.18 H new ATOM 696 N LEU A 48 -17.375 -8.930 0.723 1.00 1.18 N ATOM 697 CA LEU A 48 -16.973 -8.603 -0.647 1.00 1.29 C ATOM 698 C LEU A 48 -15.474 -8.918 -0.777 1.00 1.00 C ATOM 699 O LEU A 48 -14.646 -7.999 -0.831 1.00 1.21 O ATOM 700 CB LEU A 48 -17.242 -7.110 -0.945 1.00 1.76 C ATOM 701 CG LEU A 48 -17.211 -6.674 -2.442 1.00 1.96 C ATOM 702 CD1 LEU A 48 -18.521 -6.991 -3.168 1.00 2.24 C ATOM 703 CD2 LEU A 48 -16.897 -5.184 -2.574 1.00 2.63 C ATOM 0 H LEU A 48 -16.582 -9.030 1.357 1.00 1.18 H new ATOM 0 HA LEU A 48 -17.547 -9.189 -1.364 1.00 1.29 H new ATOM 0 HB2 LEU A 48 -18.219 -6.853 -0.537 1.00 1.76 H new ATOM 0 HB3 LEU A 48 -16.505 -6.517 -0.403 1.00 1.76 H new ATOM 0 HG LEU A 48 -16.417 -7.252 -2.915 1.00 1.96 H new ATOM 0 HD11 LEU A 48 -18.449 -6.668 -4.207 1.00 2.24 H new ATOM 0 HD12 LEU A 48 -18.705 -8.065 -3.134 1.00 2.24 H new ATOM 0 HD13 LEU A 48 -19.343 -6.466 -2.681 1.00 2.24 H new ATOM 0 HD21 LEU A 48 -16.882 -4.907 -3.628 1.00 2.63 H new ATOM 0 HD22 LEU A 48 -17.662 -4.604 -2.058 1.00 2.63 H new ATOM 0 HD23 LEU A 48 -15.923 -4.977 -2.130 1.00 2.63 H new ATOM 715 N PRO A 49 -15.088 -10.243 -0.810 1.00 0.82 N ATOM 716 CA PRO A 49 -13.658 -10.692 -0.884 1.00 0.89 C ATOM 717 C PRO A 49 -12.881 -10.379 -2.183 1.00 0.75 C ATOM 718 O PRO A 49 -13.470 -10.162 -3.245 1.00 0.78 O ATOM 719 CB PRO A 49 -13.758 -12.230 -0.752 1.00 1.31 C ATOM 720 CG PRO A 49 -15.096 -12.478 -0.128 1.00 1.37 C ATOM 721 CD PRO A 49 -15.996 -11.420 -0.719 1.00 1.05 C ATOM 0 HA PRO A 49 -13.098 -10.157 -0.117 1.00 0.89 H new ATOM 0 HB2 PRO A 49 -13.680 -12.716 -1.725 1.00 1.31 H new ATOM 0 HB3 PRO A 49 -12.954 -12.626 -0.132 1.00 1.31 H new ATOM 0 HG2 PRO A 49 -15.460 -13.480 -0.356 1.00 1.37 H new ATOM 0 HG3 PRO A 49 -15.048 -12.396 0.958 1.00 1.37 H new ATOM 0 HD2 PRO A 49 -16.381 -11.713 -1.696 1.00 1.05 H new ATOM 0 HD3 PRO A 49 -16.859 -11.219 -0.084 1.00 1.05 H new ATOM 729 N ILE A 50 -11.527 -10.372 -2.055 1.00 0.67 N ATOM 730 CA ILE A 50 -10.603 -10.142 -3.172 1.00 0.60 C ATOM 731 C ILE A 50 -10.246 -11.529 -3.846 1.00 0.64 C ATOM 732 O ILE A 50 -9.831 -12.486 -3.177 1.00 0.69 O ATOM 733 CB ILE A 50 -9.363 -9.187 -2.655 1.00 0.57 C ATOM 734 CG1 ILE A 50 -9.560 -7.717 -3.143 1.00 0.54 C ATOM 735 CG2 ILE A 50 -7.929 -9.607 -3.088 1.00 0.59 C ATOM 736 CD1 ILE A 50 -10.702 -6.942 -2.506 1.00 0.59 C ATOM 0 H ILE A 50 -11.055 -10.528 -1.164 1.00 0.67 H new ATOM 0 HA ILE A 50 -11.042 -9.570 -3.990 1.00 0.60 H new ATOM 0 HB ILE A 50 -9.415 -9.297 -1.572 1.00 0.57 H new ATOM 0 HG12 ILE A 50 -8.634 -7.170 -2.964 1.00 0.54 H new ATOM 0 HG13 ILE A 50 -9.717 -7.733 -4.221 1.00 0.54 H new ATOM 0 HG21 ILE A 50 -7.205 -8.899 -2.684 1.00 0.59 H new ATOM 0 HG22 ILE A 50 -7.712 -10.605 -2.707 1.00 0.59 H new ATOM 0 HG23 ILE A 50 -7.864 -9.612 -4.176 1.00 0.59 H new ATOM 0 HD11 ILE A 50 -10.738 -5.936 -2.925 1.00 0.59 H new ATOM 0 HD12 ILE A 50 -11.644 -7.452 -2.706 1.00 0.59 H new ATOM 0 HD13 ILE A 50 -10.544 -6.881 -1.429 1.00 0.59 H new ATOM 748 N LEU A 51 -10.420 -11.578 -5.184 1.00 0.65 N ATOM 749 CA LEU A 51 -10.207 -12.804 -6.009 1.00 0.71 C ATOM 750 C LEU A 51 -8.747 -13.061 -6.481 1.00 0.78 C ATOM 751 O LEU A 51 -8.452 -14.158 -6.968 1.00 1.26 O ATOM 752 CB LEU A 51 -11.104 -12.734 -7.261 1.00 0.74 C ATOM 753 CG LEU A 51 -12.572 -13.248 -7.142 1.00 0.86 C ATOM 754 CD1 LEU A 51 -13.524 -12.152 -6.658 1.00 1.22 C ATOM 755 CD2 LEU A 51 -13.065 -13.795 -8.482 1.00 1.28 C ATOM 0 H LEU A 51 -10.713 -10.769 -5.732 1.00 0.65 H new ATOM 0 HA LEU A 51 -10.459 -13.631 -5.345 1.00 0.71 H new ATOM 0 HB2 LEU A 51 -11.140 -11.695 -7.588 1.00 0.74 H new ATOM 0 HB3 LEU A 51 -10.615 -13.301 -8.054 1.00 0.74 H new ATOM 0 HG LEU A 51 -12.568 -14.048 -6.402 1.00 0.86 H new ATOM 0 HD11 LEU A 51 -14.535 -12.553 -6.589 1.00 1.22 H new ATOM 0 HD12 LEU A 51 -13.205 -11.801 -5.677 1.00 1.22 H new ATOM 0 HD13 LEU A 51 -13.510 -11.321 -7.363 1.00 1.22 H new ATOM 0 HD21 LEU A 51 -14.091 -14.148 -8.376 1.00 1.28 H new ATOM 0 HD22 LEU A 51 -13.029 -13.006 -9.233 1.00 1.28 H new ATOM 0 HD23 LEU A 51 -12.427 -14.622 -8.794 1.00 1.28 H new ATOM 767 N ARG A 52 -7.841 -12.069 -6.339 1.00 0.58 N ATOM 768 CA ARG A 52 -6.428 -12.234 -6.751 1.00 0.58 C ATOM 769 C ARG A 52 -5.449 -12.484 -5.555 1.00 0.57 C ATOM 770 O ARG A 52 -4.242 -12.245 -5.677 1.00 0.65 O ATOM 771 CB ARG A 52 -5.974 -10.991 -7.554 1.00 0.57 C ATOM 772 CG ARG A 52 -5.518 -11.263 -9.014 1.00 0.70 C ATOM 773 CD ARG A 52 -6.686 -11.605 -9.959 1.00 0.64 C ATOM 774 NE ARG A 52 -6.220 -11.882 -11.315 1.00 0.87 N ATOM 775 CZ ARG A 52 -7.022 -12.252 -12.310 1.00 1.19 C ATOM 776 NH1 ARG A 52 -8.327 -12.380 -12.103 1.00 1.34 N ATOM 777 NH2 ARG A 52 -6.520 -12.489 -13.514 1.00 1.51 N ATOM 0 H ARG A 52 -8.059 -11.153 -5.946 1.00 0.58 H new ATOM 0 HA ARG A 52 -6.386 -13.129 -7.372 1.00 0.58 H new ATOM 0 HB2 ARG A 52 -6.796 -10.276 -7.577 1.00 0.57 H new ATOM 0 HB3 ARG A 52 -5.152 -10.515 -7.019 1.00 0.57 H new ATOM 0 HG2 ARG A 52 -4.996 -10.385 -9.395 1.00 0.70 H new ATOM 0 HG3 ARG A 52 -4.803 -12.086 -9.018 1.00 0.70 H new ATOM 0 HD2 ARG A 52 -7.223 -12.472 -9.575 1.00 0.64 H new ATOM 0 HD3 ARG A 52 -7.393 -10.775 -9.979 1.00 0.64 H new ATOM 0 HE ARG A 52 -5.223 -11.786 -11.510 1.00 0.87 H new ATOM 0 HH11 ARG A 52 -8.717 -12.195 -11.179 1.00 1.34 H new ATOM 0 HH12 ARG A 52 -8.939 -12.664 -12.868 1.00 1.34 H new ATOM 0 HH21 ARG A 52 -5.518 -12.388 -13.678 1.00 1.51 H new ATOM 0 HH22 ARG A 52 -7.135 -12.773 -14.276 1.00 1.51 H new ATOM 791 N SER A 53 -5.981 -12.982 -4.412 1.00 0.53 N ATOM 792 CA SER A 53 -5.175 -13.278 -3.217 1.00 0.54 C ATOM 793 C SER A 53 -5.674 -14.565 -2.477 1.00 0.57 C ATOM 794 O SER A 53 -6.413 -15.391 -3.031 1.00 0.67 O ATOM 795 CB SER A 53 -5.196 -12.042 -2.279 1.00 0.53 C ATOM 796 OG SER A 53 -4.003 -11.944 -1.507 1.00 1.09 O ATOM 0 H SER A 53 -6.974 -13.186 -4.299 1.00 0.53 H new ATOM 0 HA SER A 53 -4.150 -13.483 -3.526 1.00 0.54 H new ATOM 0 HB2 SER A 53 -5.320 -11.137 -2.873 1.00 0.53 H new ATOM 0 HB3 SER A 53 -6.056 -12.106 -1.613 1.00 0.53 H new ATOM 0 HG SER A 53 -3.611 -11.053 -1.623 1.00 1.09 H new ATOM 802 N ASN A 54 -5.233 -14.710 -1.209 1.00 0.59 N ATOM 803 CA ASN A 54 -5.581 -15.840 -0.299 1.00 0.64 C ATOM 804 C ASN A 54 -6.788 -15.464 0.636 1.00 0.63 C ATOM 805 O ASN A 54 -7.335 -14.378 0.488 1.00 0.66 O ATOM 806 CB ASN A 54 -4.332 -16.091 0.571 1.00 0.80 C ATOM 807 CG ASN A 54 -3.758 -17.501 0.543 1.00 0.85 C ATOM 808 OD1 ASN A 54 -3.970 -18.271 -0.397 1.00 1.27 O ATOM 809 ND2 ASN A 54 -3.004 -17.822 1.593 1.00 1.12 N ATOM 0 H ASN A 54 -4.609 -14.032 -0.772 1.00 0.59 H new ATOM 0 HA ASN A 54 -5.871 -16.718 -0.877 1.00 0.64 H new ATOM 0 HB2 ASN A 54 -3.552 -15.398 0.256 1.00 0.80 H new ATOM 0 HB3 ASN A 54 -4.580 -15.844 1.603 1.00 0.80 H new ATOM 0 HD21 ASN A 54 -2.569 -18.743 1.646 1.00 1.12 H new ATOM 0 HD22 ASN A 54 -2.861 -17.147 2.344 1.00 1.12 H new ATOM 816 N PRO A 55 -7.289 -16.367 1.573 1.00 0.71 N ATOM 817 CA PRO A 55 -8.366 -16.005 2.578 1.00 0.75 C ATOM 818 C PRO A 55 -7.827 -15.055 3.691 1.00 0.74 C ATOM 819 O PRO A 55 -8.404 -13.988 4.000 1.00 0.80 O ATOM 820 CB PRO A 55 -8.772 -17.366 3.191 1.00 0.89 C ATOM 821 CG PRO A 55 -8.248 -18.391 2.221 1.00 0.95 C ATOM 822 CD PRO A 55 -6.957 -17.806 1.682 1.00 0.83 C ATOM 0 HA PRO A 55 -9.195 -15.473 2.111 1.00 0.75 H new ATOM 0 HB2 PRO A 55 -8.338 -17.500 4.182 1.00 0.89 H new ATOM 0 HB3 PRO A 55 -9.853 -17.443 3.304 1.00 0.89 H new ATOM 0 HG2 PRO A 55 -8.071 -19.346 2.715 1.00 0.95 H new ATOM 0 HG3 PRO A 55 -8.962 -18.575 1.418 1.00 0.95 H new ATOM 0 HD2 PRO A 55 -6.118 -17.981 2.356 1.00 0.83 H new ATOM 0 HD3 PRO A 55 -6.686 -18.236 0.718 1.00 0.83 H new ATOM 830 N GLU A 56 -6.626 -15.444 4.200 1.00 0.71 N ATOM 831 CA GLU A 56 -5.837 -14.701 5.236 1.00 0.73 C ATOM 832 C GLU A 56 -5.243 -13.374 4.663 1.00 0.65 C ATOM 833 O GLU A 56 -5.368 -12.275 5.257 1.00 0.67 O ATOM 834 CB GLU A 56 -4.697 -15.619 5.777 1.00 0.80 C ATOM 835 CG GLU A 56 -3.953 -16.461 4.727 1.00 0.97 C ATOM 836 CD GLU A 56 -2.859 -17.312 5.344 1.00 1.48 C ATOM 837 OE1 GLU A 56 -1.819 -16.746 5.741 1.00 1.63 O ATOM 838 OE2 GLU A 56 -3.041 -18.545 5.429 1.00 2.04 O ATOM 0 H GLU A 56 -6.164 -16.302 3.898 1.00 0.71 H new ATOM 0 HA GLU A 56 -6.508 -14.432 6.052 1.00 0.73 H new ATOM 0 HB2 GLU A 56 -3.969 -14.994 6.294 1.00 0.80 H new ATOM 0 HB3 GLU A 56 -5.123 -16.294 6.520 1.00 0.80 H new ATOM 0 HG2 GLU A 56 -4.664 -17.105 4.210 1.00 0.97 H new ATOM 0 HG3 GLU A 56 -3.518 -15.801 3.977 1.00 0.97 H new ATOM 845 N ASP A 57 -4.692 -13.481 3.429 1.00 0.62 N ATOM 846 CA ASP A 57 -4.148 -12.330 2.697 1.00 0.58 C ATOM 847 C ASP A 57 -5.265 -11.532 1.910 1.00 0.52 C ATOM 848 O ASP A 57 -4.974 -10.549 1.230 1.00 0.53 O ATOM 849 CB ASP A 57 -3.026 -12.795 1.774 1.00 0.60 C ATOM 850 CG ASP A 57 -1.778 -11.946 1.890 1.00 1.08 C ATOM 851 OD1 ASP A 57 -1.260 -11.830 3.014 1.00 1.62 O ATOM 852 OD2 ASP A 57 -1.326 -11.399 0.863 1.00 1.62 O ATOM 0 H ASP A 57 -4.616 -14.364 2.924 1.00 0.62 H new ATOM 0 HA ASP A 57 -3.738 -11.628 3.423 1.00 0.58 H new ATOM 0 HB2 ASP A 57 -2.778 -13.831 2.006 1.00 0.60 H new ATOM 0 HB3 ASP A 57 -3.379 -12.775 0.743 1.00 0.60 H new ATOM 857 N GLN A 58 -6.556 -12.001 2.049 1.00 0.52 N ATOM 858 CA GLN A 58 -7.786 -11.333 1.541 1.00 0.51 C ATOM 859 C GLN A 58 -8.106 -10.184 2.517 1.00 0.50 C ATOM 860 O GLN A 58 -8.394 -9.077 2.103 1.00 0.49 O ATOM 861 CB GLN A 58 -8.968 -12.333 1.502 1.00 0.60 C ATOM 862 CG GLN A 58 -10.362 -11.719 1.288 1.00 0.84 C ATOM 863 CD GLN A 58 -11.474 -12.652 1.730 1.00 0.91 C ATOM 864 OE1 GLN A 58 -12.507 -12.208 2.230 1.00 1.16 O ATOM 865 NE2 GLN A 58 -11.276 -13.951 1.536 1.00 1.77 N ATOM 0 H GLN A 58 -6.760 -12.876 2.531 1.00 0.52 H new ATOM 0 HA GLN A 58 -7.632 -10.961 0.528 1.00 0.51 H new ATOM 0 HB2 GLN A 58 -8.783 -13.053 0.705 1.00 0.60 H new ATOM 0 HB3 GLN A 58 -8.978 -12.890 2.439 1.00 0.60 H new ATOM 0 HG2 GLN A 58 -10.434 -10.783 1.842 1.00 0.84 H new ATOM 0 HG3 GLN A 58 -10.492 -11.476 0.233 1.00 0.84 H new ATOM 0 HE21 GLN A 58 -10.405 -14.277 1.118 1.00 1.77 H new ATOM 0 HE22 GLN A 58 -11.995 -14.622 1.805 1.00 1.77 H new ATOM 874 N VAL A 59 -7.975 -10.497 3.850 1.00 0.52 N ATOM 875 CA VAL A 59 -8.107 -9.499 4.984 1.00 0.54 C ATOM 876 C VAL A 59 -6.999 -8.387 4.825 1.00 0.52 C ATOM 877 O VAL A 59 -7.306 -7.210 4.952 1.00 0.55 O ATOM 878 CB VAL A 59 -8.023 -10.191 6.444 1.00 0.55 C ATOM 879 CG1 VAL A 59 -8.181 -9.211 7.643 1.00 0.80 C ATOM 880 CG2 VAL A 59 -9.095 -11.264 6.636 1.00 0.81 C ATOM 0 H VAL A 59 -7.776 -11.444 4.173 1.00 0.52 H new ATOM 0 HA VAL A 59 -9.098 -9.050 4.921 1.00 0.54 H new ATOM 0 HB VAL A 59 -7.017 -10.610 6.452 1.00 0.55 H new ATOM 0 HG11 VAL A 59 -8.111 -9.766 8.578 1.00 0.80 H new ATOM 0 HG12 VAL A 59 -7.391 -8.461 7.606 1.00 0.80 H new ATOM 0 HG13 VAL A 59 -9.152 -8.719 7.585 1.00 0.80 H new ATOM 0 HG21 VAL A 59 -8.999 -11.700 7.630 1.00 0.81 H new ATOM 0 HG22 VAL A 59 -10.082 -10.815 6.531 1.00 0.81 H new ATOM 0 HG23 VAL A 59 -8.969 -12.043 5.884 1.00 0.81 H new ATOM 890 N LEU A 60 -5.726 -8.788 4.516 1.00 0.49 N ATOM 891 CA LEU A 60 -4.629 -7.800 4.253 1.00 0.48 C ATOM 892 C LEU A 60 -4.800 -6.960 2.924 1.00 0.49 C ATOM 893 O LEU A 60 -4.366 -5.814 2.862 1.00 0.65 O ATOM 894 CB LEU A 60 -3.298 -8.564 4.198 1.00 0.52 C ATOM 895 CG LEU A 60 -1.993 -7.731 4.409 1.00 0.71 C ATOM 896 CD1 LEU A 60 -1.696 -7.477 5.880 1.00 1.15 C ATOM 897 CD2 LEU A 60 -0.753 -8.365 3.775 1.00 0.90 C ATOM 0 H LEU A 60 -5.439 -9.764 4.444 1.00 0.49 H new ATOM 0 HA LEU A 60 -4.660 -7.075 5.066 1.00 0.48 H new ATOM 0 HB2 LEU A 60 -3.326 -9.348 4.955 1.00 0.52 H new ATOM 0 HB3 LEU A 60 -3.231 -9.059 3.229 1.00 0.52 H new ATOM 0 HG LEU A 60 -2.199 -6.787 3.905 1.00 0.71 H new ATOM 0 HD11 LEU A 60 -0.779 -6.894 5.971 1.00 1.15 H new ATOM 0 HD12 LEU A 60 -2.522 -6.925 6.328 1.00 1.15 H new ATOM 0 HD13 LEU A 60 -1.573 -8.429 6.396 1.00 1.15 H new ATOM 0 HD21 LEU A 60 0.115 -7.732 3.961 1.00 0.90 H new ATOM 0 HD22 LEU A 60 -0.585 -9.350 4.211 1.00 0.90 H new ATOM 0 HD23 LEU A 60 -0.905 -8.465 2.700 1.00 0.90 H new ATOM 909 N TYR A 61 -5.461 -7.556 1.902 1.00 0.44 N ATOM 910 CA TYR A 61 -5.724 -6.910 0.576 1.00 0.45 C ATOM 911 C TYR A 61 -7.218 -6.448 0.369 1.00 0.47 C ATOM 912 O TYR A 61 -7.619 -6.147 -0.761 1.00 0.52 O ATOM 913 CB TYR A 61 -5.395 -7.916 -0.553 1.00 0.44 C ATOM 914 CG TYR A 61 -3.913 -8.299 -0.785 1.00 0.46 C ATOM 915 CD1 TYR A 61 -2.923 -8.148 0.195 1.00 0.70 C ATOM 916 CD2 TYR A 61 -3.519 -8.858 -2.007 1.00 0.76 C ATOM 917 CE1 TYR A 61 -1.611 -8.532 -0.044 1.00 0.72 C ATOM 918 CE2 TYR A 61 -2.210 -9.248 -2.238 1.00 0.92 C ATOM 919 CZ TYR A 61 -1.265 -9.081 -1.255 1.00 0.72 C ATOM 920 OH TYR A 61 0.035 -9.467 -1.485 1.00 0.88 O ATOM 0 H TYR A 61 -5.832 -8.504 1.967 1.00 0.44 H new ATOM 0 HA TYR A 61 -5.094 -6.021 0.549 1.00 0.45 H new ATOM 0 HB2 TYR A 61 -5.948 -8.834 -0.352 1.00 0.44 H new ATOM 0 HB3 TYR A 61 -5.783 -7.507 -1.486 1.00 0.44 H new ATOM 0 HD1 TYR A 61 -3.186 -7.725 1.153 1.00 0.70 H new ATOM 0 HD2 TYR A 61 -4.253 -8.988 -2.788 1.00 0.76 H new ATOM 0 HE1 TYR A 61 -0.862 -8.399 0.722 1.00 0.72 H new ATOM 0 HE2 TYR A 61 -1.933 -9.682 -3.188 1.00 0.92 H new ATOM 0 HH TYR A 61 0.111 -9.837 -2.389 1.00 0.88 H new ATOM 930 N GLN A 62 -8.019 -6.382 1.458 1.00 0.50 N ATOM 931 CA GLN A 62 -9.484 -6.011 1.380 1.00 0.57 C ATOM 932 C GLN A 62 -9.994 -5.032 2.471 1.00 0.70 C ATOM 933 O GLN A 62 -11.008 -4.363 2.260 1.00 1.33 O ATOM 934 CB GLN A 62 -10.360 -7.296 1.446 1.00 0.57 C ATOM 935 CG GLN A 62 -11.845 -7.153 1.006 1.00 0.75 C ATOM 936 CD GLN A 62 -12.831 -7.364 2.146 1.00 0.77 C ATOM 937 OE1 GLN A 62 -13.309 -6.405 2.752 1.00 1.26 O ATOM 938 NE2 GLN A 62 -13.121 -8.621 2.461 1.00 1.02 N ATOM 0 H GLN A 62 -7.694 -6.577 2.405 1.00 0.50 H new ATOM 0 HA GLN A 62 -9.576 -5.486 0.429 1.00 0.57 H new ATOM 0 HB2 GLN A 62 -9.893 -8.059 0.823 1.00 0.57 H new ATOM 0 HB3 GLN A 62 -10.343 -7.667 2.471 1.00 0.57 H new ATOM 0 HG2 GLN A 62 -11.997 -6.161 0.581 1.00 0.75 H new ATOM 0 HG3 GLN A 62 -12.054 -7.874 0.215 1.00 0.75 H new ATOM 0 HE21 GLN A 62 -12.704 -9.388 1.934 1.00 1.02 H new ATOM 0 HE22 GLN A 62 -13.761 -8.819 3.230 1.00 1.02 H new ATOM 947 N THR A 63 -9.318 -4.959 3.626 1.00 0.58 N ATOM 948 CA THR A 63 -9.740 -4.058 4.779 1.00 0.62 C ATOM 949 C THR A 63 -9.293 -2.553 4.595 1.00 0.76 C ATOM 950 O THR A 63 -8.150 -2.289 4.227 1.00 1.28 O ATOM 951 CB THR A 63 -9.256 -4.614 6.181 1.00 0.59 C ATOM 952 OG1 THR A 63 -7.837 -4.850 6.205 1.00 0.63 O ATOM 953 CG2 THR A 63 -9.996 -5.905 6.602 1.00 0.60 C ATOM 0 H THR A 63 -8.474 -5.500 3.815 1.00 0.58 H new ATOM 0 HA THR A 63 -10.830 -4.070 4.764 1.00 0.62 H new ATOM 0 HB THR A 63 -9.500 -3.832 6.900 1.00 0.59 H new ATOM 0 HG1 THR A 63 -7.624 -5.619 5.637 1.00 0.63 H new ATOM 0 HG21 THR A 63 -9.623 -6.239 7.570 1.00 0.60 H new ATOM 0 HG22 THR A 63 -11.065 -5.704 6.675 1.00 0.60 H new ATOM 0 HG23 THR A 63 -9.823 -6.683 5.858 1.00 0.60 H new ATOM 961 N GLU A 64 -10.214 -1.588 4.890 1.00 0.57 N ATOM 962 CA GLU A 64 -9.961 -0.110 4.703 1.00 0.60 C ATOM 963 C GLU A 64 -9.998 0.750 5.989 1.00 0.64 C ATOM 964 O GLU A 64 -10.766 0.493 6.918 1.00 0.69 O ATOM 965 CB GLU A 64 -11.040 0.504 3.768 1.00 0.67 C ATOM 966 CG GLU A 64 -12.485 0.030 4.037 1.00 0.84 C ATOM 967 CD GLU A 64 -13.514 1.099 3.724 1.00 1.07 C ATOM 968 OE1 GLU A 64 -13.388 1.755 2.669 1.00 1.53 O ATOM 969 OE2 GLU A 64 -14.451 1.278 4.530 1.00 1.50 O ATOM 0 H GLU A 64 -11.141 -1.799 5.259 1.00 0.57 H new ATOM 0 HA GLU A 64 -8.949 -0.079 4.299 1.00 0.60 H new ATOM 0 HB2 GLU A 64 -11.006 1.589 3.863 1.00 0.67 H new ATOM 0 HB3 GLU A 64 -10.782 0.266 2.736 1.00 0.67 H new ATOM 0 HG2 GLU A 64 -12.691 -0.856 3.436 1.00 0.84 H new ATOM 0 HG3 GLU A 64 -12.579 -0.265 5.082 1.00 0.84 H new ATOM 976 N ARG A 65 -9.129 1.782 6.000 1.00 0.74 N ATOM 977 CA ARG A 65 -9.056 2.772 7.092 1.00 0.91 C ATOM 978 C ARG A 65 -9.082 4.201 6.504 1.00 1.19 C ATOM 979 O ARG A 65 -8.088 4.664 5.929 1.00 2.12 O ATOM 980 CB ARG A 65 -7.771 2.597 7.936 1.00 0.98 C ATOM 981 CG ARG A 65 -7.906 3.053 9.407 1.00 0.90 C ATOM 982 CD ARG A 65 -6.568 3.042 10.172 1.00 0.96 C ATOM 983 NE ARG A 65 -6.719 3.574 11.530 1.00 1.63 N ATOM 984 CZ ARG A 65 -6.742 4.873 11.837 1.00 2.39 C ATOM 985 NH1 ARG A 65 -6.607 5.793 10.890 1.00 2.86 N ATOM 986 NH2 ARG A 65 -6.905 5.249 13.096 1.00 3.22 N ATOM 0 H ARG A 65 -8.458 1.952 5.251 1.00 0.74 H new ATOM 0 HA ARG A 65 -9.918 2.613 7.740 1.00 0.91 H new ATOM 0 HB2 ARG A 65 -7.480 1.547 7.919 1.00 0.98 H new ATOM 0 HB3 ARG A 65 -6.963 3.159 7.467 1.00 0.98 H new ATOM 0 HG2 ARG A 65 -8.323 4.060 9.432 1.00 0.90 H new ATOM 0 HG3 ARG A 65 -8.615 2.402 9.919 1.00 0.90 H new ATOM 0 HD2 ARG A 65 -6.184 2.023 10.220 1.00 0.96 H new ATOM 0 HD3 ARG A 65 -5.832 3.634 9.628 1.00 0.96 H new ATOM 0 HE ARG A 65 -6.813 2.905 12.294 1.00 1.63 H new ATOM 0 HH11 ARG A 65 -6.484 5.510 9.918 1.00 2.86 H new ATOM 0 HH12 ARG A 65 -6.626 6.783 11.134 1.00 2.86 H new ATOM 0 HH21 ARG A 65 -7.013 4.547 13.828 1.00 3.22 H new ATOM 0 HH22 ARG A 65 -6.923 6.241 13.334 1.00 3.22 H new ATOM 1000 N TYR A 66 -10.230 4.894 6.649 1.00 0.77 N ATOM 1001 CA TYR A 66 -10.388 6.270 6.127 1.00 0.92 C ATOM 1002 C TYR A 66 -10.708 7.291 7.244 1.00 1.10 C ATOM 1003 O TYR A 66 -11.485 7.011 8.167 1.00 1.80 O ATOM 1004 CB TYR A 66 -11.452 6.322 4.989 1.00 1.58 C ATOM 1005 CG TYR A 66 -12.900 5.950 5.386 1.00 1.83 C ATOM 1006 CD1 TYR A 66 -13.244 4.632 5.698 1.00 2.35 C ATOM 1007 CD2 TYR A 66 -13.922 6.913 5.426 1.00 2.21 C ATOM 1008 CE1 TYR A 66 -14.545 4.289 6.037 1.00 2.90 C ATOM 1009 CE2 TYR A 66 -15.222 6.565 5.768 1.00 2.72 C ATOM 1010 CZ TYR A 66 -15.523 5.257 6.069 1.00 2.96 C ATOM 1011 OH TYR A 66 -16.811 4.913 6.407 1.00 3.66 O ATOM 0 H TYR A 66 -11.057 4.528 7.120 1.00 0.77 H new ATOM 0 HA TYR A 66 -9.426 6.560 5.703 1.00 0.92 H new ATOM 0 HB2 TYR A 66 -11.459 7.330 4.574 1.00 1.58 H new ATOM 0 HB3 TYR A 66 -11.133 5.651 4.192 1.00 1.58 H new ATOM 0 HD1 TYR A 66 -12.483 3.866 5.675 1.00 2.35 H new ATOM 0 HD2 TYR A 66 -13.693 7.941 5.187 1.00 2.21 H new ATOM 0 HE1 TYR A 66 -14.790 3.264 6.275 1.00 2.90 H new ATOM 0 HE2 TYR A 66 -15.995 7.319 5.798 1.00 2.72 H new ATOM 0 HH TYR A 66 -17.379 5.711 6.384 1.00 3.66 H new ATOM 1021 N ASN A 67 -10.105 8.492 7.127 1.00 1.30 N ATOM 1022 CA ASN A 67 -10.280 9.568 8.126 1.00 1.97 C ATOM 1023 C ASN A 67 -11.029 10.802 7.565 1.00 1.59 C ATOM 1024 O ASN A 67 -12.213 10.981 7.862 1.00 1.69 O ATOM 1025 CB ASN A 67 -8.914 9.987 8.707 1.00 3.06 C ATOM 1026 CG ASN A 67 -8.600 9.312 10.038 1.00 3.99 C ATOM 1027 OD1 ASN A 67 -8.897 9.849 11.104 1.00 4.39 O ATOM 1028 ND2 ASN A 67 -8.004 8.127 9.975 1.00 4.70 N ATOM 0 H ASN A 67 -9.492 8.742 6.351 1.00 1.30 H new ATOM 0 HA ASN A 67 -10.905 9.159 8.920 1.00 1.97 H new ATOM 0 HB2 ASN A 67 -8.130 9.745 7.989 1.00 3.06 H new ATOM 0 HB3 ASN A 67 -8.899 11.069 8.842 1.00 3.06 H new ATOM 0 HD21 ASN A 67 -7.775 7.625 10.833 1.00 4.70 H new ATOM 0 HD22 ASN A 67 -7.776 7.719 9.069 1.00 4.70 H new ATOM 1035 N GLU A 68 -10.345 11.651 6.760 1.00 1.31 N ATOM 1036 CA GLU A 68 -10.979 12.857 6.205 1.00 1.11 C ATOM 1037 C GLU A 68 -10.526 13.170 4.753 1.00 0.91 C ATOM 1038 O GLU A 68 -11.124 12.653 3.805 1.00 1.18 O ATOM 1039 CB GLU A 68 -10.740 14.064 7.156 1.00 1.42 C ATOM 1040 CG GLU A 68 -11.672 15.268 6.927 1.00 1.26 C ATOM 1041 CD GLU A 68 -11.339 16.437 7.837 1.00 1.99 C ATOM 1042 OE1 GLU A 68 -11.808 16.441 8.994 1.00 2.25 O ATOM 1043 OE2 GLU A 68 -10.608 17.347 7.392 1.00 2.55 O ATOM 0 H GLU A 68 -9.371 11.521 6.488 1.00 1.31 H new ATOM 0 HA GLU A 68 -12.050 12.664 6.139 1.00 1.11 H new ATOM 0 HB2 GLU A 68 -10.856 13.725 8.185 1.00 1.42 H new ATOM 0 HB3 GLU A 68 -9.708 14.396 7.044 1.00 1.42 H new ATOM 0 HG2 GLU A 68 -11.600 15.588 5.887 1.00 1.26 H new ATOM 0 HG3 GLU A 68 -12.705 14.962 7.095 1.00 1.26 H new ATOM 1050 N ASP A 69 -9.459 13.995 4.585 1.00 0.76 N ATOM 1051 CA ASP A 69 -8.955 14.426 3.250 1.00 0.75 C ATOM 1052 C ASP A 69 -7.495 14.908 3.352 1.00 0.69 C ATOM 1053 O ASP A 69 -7.186 15.795 4.160 1.00 1.33 O ATOM 1054 CB ASP A 69 -9.810 15.586 2.677 1.00 1.17 C ATOM 1055 CG ASP A 69 -10.917 15.154 1.711 1.00 1.63 C ATOM 1056 OD1 ASP A 69 -10.741 14.140 1.003 1.00 2.06 O ATOM 1057 OD2 ASP A 69 -11.966 15.833 1.672 1.00 2.15 O ATOM 0 H ASP A 69 -8.926 14.379 5.365 1.00 0.76 H new ATOM 0 HA ASP A 69 -9.020 13.563 2.588 1.00 0.75 H new ATOM 0 HB2 ASP A 69 -10.263 16.128 3.507 1.00 1.17 H new ATOM 0 HB3 ASP A 69 -9.150 16.284 2.162 1.00 1.17 H new ATOM 1062 N SER A 70 -6.588 14.316 2.507 1.00 0.72 N ATOM 1063 CA SER A 70 -5.107 14.628 2.468 1.00 0.57 C ATOM 1064 C SER A 70 -4.385 14.047 3.704 1.00 0.53 C ATOM 1065 O SER A 70 -4.173 14.743 4.705 1.00 0.57 O ATOM 1066 CB SER A 70 -4.833 16.144 2.318 1.00 0.70 C ATOM 1067 OG SER A 70 -3.712 16.393 1.483 1.00 0.77 O ATOM 0 H SER A 70 -6.860 13.605 1.829 1.00 0.72 H new ATOM 0 HA SER A 70 -4.700 14.144 1.580 1.00 0.57 H new ATOM 0 HB2 SER A 70 -5.713 16.634 1.902 1.00 0.70 H new ATOM 0 HB3 SER A 70 -4.659 16.582 3.301 1.00 0.70 H new ATOM 0 HG SER A 70 -3.568 17.359 1.408 1.00 0.77 H new ATOM 1073 N PHE A 71 -4.026 12.762 3.610 1.00 0.49 N ATOM 1074 CA PHE A 71 -3.400 12.050 4.739 1.00 0.47 C ATOM 1075 C PHE A 71 -2.389 10.981 4.291 1.00 0.33 C ATOM 1076 O PHE A 71 -2.483 10.423 3.183 1.00 0.39 O ATOM 1077 CB PHE A 71 -4.505 11.433 5.655 1.00 0.66 C ATOM 1078 CG PHE A 71 -5.647 10.706 4.927 1.00 0.54 C ATOM 1079 CD1 PHE A 71 -5.512 9.378 4.521 1.00 0.73 C ATOM 1080 CD2 PHE A 71 -6.859 11.355 4.664 1.00 0.75 C ATOM 1081 CE1 PHE A 71 -6.551 8.719 3.877 1.00 0.78 C ATOM 1082 CE2 PHE A 71 -7.894 10.697 4.020 1.00 0.81 C ATOM 1083 CZ PHE A 71 -7.743 9.381 3.627 1.00 0.67 C ATOM 0 H PHE A 71 -4.155 12.194 2.773 1.00 0.49 H new ATOM 0 HA PHE A 71 -2.827 12.783 5.307 1.00 0.47 H new ATOM 0 HB2 PHE A 71 -4.031 10.731 6.341 1.00 0.66 H new ATOM 0 HB3 PHE A 71 -4.935 12.230 6.261 1.00 0.66 H new ATOM 0 HD1 PHE A 71 -4.586 8.855 4.710 1.00 0.73 H new ATOM 0 HD2 PHE A 71 -6.989 12.383 4.967 1.00 0.75 H new ATOM 0 HE1 PHE A 71 -6.430 7.690 3.571 1.00 0.78 H new ATOM 0 HE2 PHE A 71 -8.822 11.214 3.825 1.00 0.81 H new ATOM 0 HZ PHE A 71 -8.552 8.869 3.126 1.00 0.67 H new ATOM 1093 N GLY A 72 -1.409 10.712 5.171 1.00 0.31 N ATOM 1094 CA GLY A 72 -0.391 9.716 4.869 1.00 0.41 C ATOM 1095 C GLY A 72 0.453 9.249 6.050 1.00 0.33 C ATOM 1096 O GLY A 72 0.188 9.565 7.211 1.00 0.47 O ATOM 0 H GLY A 72 -1.308 11.166 6.079 1.00 0.31 H new ATOM 0 HA2 GLY A 72 -0.880 8.846 4.430 1.00 0.41 H new ATOM 0 HA3 GLY A 72 0.276 10.124 4.109 1.00 0.41 H new ATOM 1100 N TYR A 73 1.487 8.472 5.716 1.00 0.28 N ATOM 1101 CA TYR A 73 2.389 7.859 6.711 1.00 0.24 C ATOM 1102 C TYR A 73 3.856 8.366 6.647 1.00 0.21 C ATOM 1103 O TYR A 73 4.265 9.076 5.712 1.00 0.27 O ATOM 1104 CB TYR A 73 2.419 6.325 6.539 1.00 0.36 C ATOM 1105 CG TYR A 73 1.099 5.638 6.134 1.00 0.33 C ATOM 1106 CD1 TYR A 73 0.513 5.836 4.877 1.00 0.47 C ATOM 1107 CD2 TYR A 73 0.426 4.809 7.032 1.00 0.48 C ATOM 1108 CE1 TYR A 73 -0.686 5.221 4.546 1.00 0.63 C ATOM 1109 CE2 TYR A 73 -0.763 4.200 6.698 1.00 0.62 C ATOM 1110 CZ TYR A 73 -1.265 4.383 5.343 1.00 0.68 C ATOM 1111 OH TYR A 73 -2.499 3.795 5.138 1.00 0.89 O ATOM 0 H TYR A 73 1.727 8.247 4.751 1.00 0.28 H new ATOM 0 HA TYR A 73 1.977 8.153 7.676 1.00 0.24 H new ATOM 0 HB2 TYR A 73 3.171 6.083 5.787 1.00 0.36 H new ATOM 0 HB3 TYR A 73 2.755 5.886 7.478 1.00 0.36 H new ATOM 0 HD1 TYR A 73 1.001 6.476 4.156 1.00 0.47 H new ATOM 0 HD2 TYR A 73 0.847 4.641 8.012 1.00 0.48 H new ATOM 0 HE1 TYR A 73 -1.148 5.448 3.597 1.00 0.63 H new ATOM 0 HE2 TYR A 73 -1.306 3.606 7.418 1.00 0.62 H new ATOM 0 HH TYR A 73 -2.425 2.826 5.265 1.00 0.89 H new ATOM 1121 N ASP A 74 4.645 7.927 7.659 1.00 0.17 N ATOM 1122 CA ASP A 74 6.075 8.291 7.815 1.00 0.16 C ATOM 1123 C ASP A 74 6.990 7.040 7.942 1.00 0.15 C ATOM 1124 O ASP A 74 6.711 6.126 8.727 1.00 0.24 O ATOM 1125 CB ASP A 74 6.261 9.167 9.076 1.00 0.21 C ATOM 1126 CG ASP A 74 6.003 10.656 8.849 1.00 0.26 C ATOM 1127 OD1 ASP A 74 5.063 10.987 8.097 1.00 0.51 O ATOM 1128 OD2 ASP A 74 6.740 11.483 9.425 1.00 0.40 O ATOM 0 H ASP A 74 4.305 7.307 8.394 1.00 0.17 H new ATOM 0 HA ASP A 74 6.364 8.839 6.918 1.00 0.16 H new ATOM 0 HB2 ASP A 74 5.589 8.808 9.856 1.00 0.21 H new ATOM 0 HB3 ASP A 74 7.278 9.038 9.447 1.00 0.21 H new ATOM 1133 N ILE A 75 8.096 7.030 7.165 1.00 0.10 N ATOM 1134 CA ILE A 75 9.092 5.927 7.172 1.00 0.09 C ATOM 1135 C ILE A 75 10.517 6.514 7.455 1.00 0.08 C ATOM 1136 O ILE A 75 11.117 7.088 6.552 1.00 0.12 O ATOM 1137 CB ILE A 75 9.114 5.104 5.797 1.00 0.11 C ATOM 1138 CG1 ILE A 75 7.706 4.654 5.355 1.00 0.13 C ATOM 1139 CG2 ILE A 75 9.985 3.815 5.860 1.00 0.14 C ATOM 1140 CD1 ILE A 75 7.064 5.480 4.266 1.00 0.15 C ATOM 0 H ILE A 75 8.326 7.783 6.516 1.00 0.10 H new ATOM 0 HA ILE A 75 8.800 5.231 7.959 1.00 0.09 H new ATOM 0 HB ILE A 75 9.541 5.810 5.084 1.00 0.11 H new ATOM 0 HG12 ILE A 75 7.766 3.621 5.014 1.00 0.13 H new ATOM 0 HG13 ILE A 75 7.051 4.664 6.227 1.00 0.13 H new ATOM 0 HG21 ILE A 75 9.954 3.308 4.896 1.00 0.14 H new ATOM 0 HG22 ILE A 75 11.015 4.083 6.097 1.00 0.14 H new ATOM 0 HG23 ILE A 75 9.596 3.151 6.632 1.00 0.14 H new ATOM 0 HD11 ILE A 75 6.079 5.075 4.035 1.00 0.15 H new ATOM 0 HD12 ILE A 75 6.962 6.511 4.604 1.00 0.15 H new ATOM 0 HD13 ILE A 75 7.687 5.451 3.372 1.00 0.15 H new ATOM 1152 N PRO A 76 11.077 6.400 8.700 1.00 0.09 N ATOM 1153 CA PRO A 76 12.442 6.892 8.997 1.00 0.10 C ATOM 1154 C PRO A 76 13.593 5.890 8.654 1.00 0.09 C ATOM 1155 O PRO A 76 13.646 4.781 9.194 1.00 0.11 O ATOM 1156 CB PRO A 76 12.359 7.185 10.495 1.00 0.14 C ATOM 1157 CG PRO A 76 11.436 6.115 11.031 1.00 0.15 C ATOM 1158 CD PRO A 76 10.430 5.839 9.917 1.00 0.12 C ATOM 0 HA PRO A 76 12.706 7.751 8.381 1.00 0.10 H new ATOM 0 HB2 PRO A 76 13.341 7.136 10.965 1.00 0.14 H new ATOM 0 HB3 PRO A 76 11.964 8.183 10.684 1.00 0.14 H new ATOM 0 HG2 PRO A 76 11.991 5.213 11.289 1.00 0.15 H new ATOM 0 HG3 PRO A 76 10.933 6.451 11.938 1.00 0.15 H new ATOM 0 HD2 PRO A 76 10.236 4.772 9.810 1.00 0.12 H new ATOM 0 HD3 PRO A 76 9.472 6.319 10.117 1.00 0.12 H new ATOM 1166 N ILE A 77 14.498 6.313 7.747 1.00 0.09 N ATOM 1167 CA ILE A 77 15.651 5.483 7.293 1.00 0.10 C ATOM 1168 C ILE A 77 17.002 6.265 7.441 1.00 0.13 C ATOM 1169 O ILE A 77 17.037 7.496 7.569 1.00 0.19 O ATOM 1170 CB ILE A 77 15.478 4.985 5.784 1.00 0.12 C ATOM 1171 CG1 ILE A 77 13.992 4.795 5.410 1.00 0.11 C ATOM 1172 CG2 ILE A 77 16.200 3.619 5.487 1.00 0.18 C ATOM 1173 CD1 ILE A 77 13.380 5.825 4.495 1.00 0.19 C ATOM 0 H ILE A 77 14.458 7.232 7.307 1.00 0.09 H new ATOM 0 HA ILE A 77 15.674 4.604 7.937 1.00 0.10 H new ATOM 0 HB ILE A 77 15.937 5.774 5.188 1.00 0.12 H new ATOM 0 HG12 ILE A 77 13.883 3.817 4.941 1.00 0.11 H new ATOM 0 HG13 ILE A 77 13.411 4.773 6.332 1.00 0.11 H new ATOM 0 HG21 ILE A 77 16.040 3.342 4.445 1.00 0.18 H new ATOM 0 HG22 ILE A 77 17.269 3.724 5.675 1.00 0.18 H new ATOM 0 HG23 ILE A 77 15.792 2.843 6.135 1.00 0.18 H new ATOM 0 HD11 ILE A 77 12.335 5.574 4.312 1.00 0.19 H new ATOM 0 HD12 ILE A 77 13.441 6.808 4.961 1.00 0.19 H new ATOM 0 HD13 ILE A 77 13.921 5.838 3.549 1.00 0.19 H new ATOM 1185 N LYS A 78 18.101 5.497 7.408 1.00 0.15 N ATOM 1186 CA LYS A 78 19.479 6.014 7.510 1.00 0.20 C ATOM 1187 C LYS A 78 20.495 5.109 6.746 1.00 0.21 C ATOM 1188 O LYS A 78 21.701 5.180 7.007 1.00 0.25 O ATOM 1189 CB LYS A 78 19.910 6.127 8.994 1.00 0.27 C ATOM 1190 CG LYS A 78 19.410 7.402 9.719 1.00 0.87 C ATOM 1191 CD LYS A 78 19.610 7.363 11.257 1.00 1.32 C ATOM 1192 CE LYS A 78 21.093 7.352 11.677 1.00 1.91 C ATOM 1193 NZ LYS A 78 21.863 8.455 11.037 1.00 2.53 N ATOM 0 H LYS A 78 18.060 4.483 7.308 1.00 0.15 H new ATOM 0 HA LYS A 78 19.484 7.002 7.050 1.00 0.20 H new ATOM 0 HB2 LYS A 78 19.544 5.253 9.532 1.00 0.27 H new ATOM 0 HB3 LYS A 78 20.998 6.100 9.045 1.00 0.27 H new ATOM 0 HG2 LYS A 78 19.934 8.268 9.315 1.00 0.87 H new ATOM 0 HG3 LYS A 78 18.351 7.541 9.503 1.00 0.87 H new ATOM 0 HD2 LYS A 78 19.119 8.228 11.703 1.00 1.32 H new ATOM 0 HD3 LYS A 78 19.119 6.476 11.658 1.00 1.32 H new ATOM 0 HE2 LYS A 78 21.163 7.442 12.761 1.00 1.91 H new ATOM 0 HE3 LYS A 78 21.539 6.395 11.407 1.00 1.91 H new ATOM 0 HZ1 LYS A 78 22.800 8.528 11.482 1.00 2.53 H new ATOM 0 HZ2 LYS A 78 21.977 8.256 10.023 1.00 2.53 H new ATOM 0 HZ3 LYS A 78 21.351 9.352 11.159 1.00 2.53 H new ATOM 1207 N GLU A 79 20.007 4.269 5.790 1.00 0.19 N ATOM 1208 CA GLU A 79 20.867 3.366 5.012 1.00 0.22 C ATOM 1209 C GLU A 79 20.605 3.498 3.498 1.00 0.20 C ATOM 1210 O GLU A 79 19.539 3.964 3.066 1.00 0.18 O ATOM 1211 CB GLU A 79 20.634 1.914 5.473 1.00 0.24 C ATOM 1212 CG GLU A 79 21.254 1.577 6.840 1.00 0.55 C ATOM 1213 CD GLU A 79 20.931 0.168 7.298 1.00 1.17 C ATOM 1214 OE1 GLU A 79 19.829 -0.040 7.848 1.00 2.12 O ATOM 1215 OE2 GLU A 79 21.779 -0.729 7.105 1.00 1.03 O ATOM 0 H GLU A 79 19.018 4.208 5.548 1.00 0.19 H new ATOM 0 HA GLU A 79 21.906 3.644 5.188 1.00 0.22 H new ATOM 0 HB2 GLU A 79 19.561 1.727 5.518 1.00 0.24 H new ATOM 0 HB3 GLU A 79 21.045 1.237 4.724 1.00 0.24 H new ATOM 0 HG2 GLU A 79 22.336 1.697 6.783 1.00 0.55 H new ATOM 0 HG3 GLU A 79 20.893 2.288 7.583 1.00 0.55 H new ATOM 1222 N GLU A 80 21.584 3.060 2.690 1.00 0.26 N ATOM 1223 CA GLU A 80 21.486 3.162 1.226 1.00 0.25 C ATOM 1224 C GLU A 80 21.510 1.805 0.495 1.00 0.27 C ATOM 1225 O GLU A 80 22.160 0.841 0.919 1.00 0.32 O ATOM 1226 CB GLU A 80 22.629 4.042 0.693 1.00 0.27 C ATOM 1227 CG GLU A 80 22.578 5.525 1.114 1.00 0.28 C ATOM 1228 CD GLU A 80 23.703 5.893 2.067 1.00 0.36 C ATOM 1229 OE1 GLU A 80 24.815 6.197 1.585 1.00 0.40 O ATOM 1230 OE2 GLU A 80 23.472 5.877 3.294 1.00 0.42 O ATOM 0 H GLU A 80 22.448 2.634 3.024 1.00 0.26 H new ATOM 0 HA GLU A 80 20.513 3.607 1.020 1.00 0.25 H new ATOM 0 HB2 GLU A 80 23.576 3.620 1.029 1.00 0.27 H new ATOM 0 HB3 GLU A 80 22.626 3.991 -0.396 1.00 0.27 H new ATOM 0 HG2 GLU A 80 22.636 6.155 0.226 1.00 0.28 H new ATOM 0 HG3 GLU A 80 21.619 5.733 1.590 1.00 0.28 H new ATOM 1237 N GLY A 81 20.789 1.785 -0.630 1.00 0.22 N ATOM 1238 CA GLY A 81 20.682 0.601 -1.487 1.00 0.23 C ATOM 1239 C GLY A 81 19.460 0.659 -2.399 1.00 0.19 C ATOM 1240 O GLY A 81 19.160 1.728 -2.956 1.00 0.18 O ATOM 0 H GLY A 81 20.263 2.589 -0.972 1.00 0.22 H new ATOM 0 HA2 GLY A 81 21.583 0.511 -2.094 1.00 0.23 H new ATOM 0 HA3 GLY A 81 20.627 -0.292 -0.865 1.00 0.23 H new ATOM 1244 N GLU A 82 18.743 -0.481 -2.596 1.00 0.20 N ATOM 1245 CA GLU A 82 17.534 -0.450 -3.429 1.00 0.17 C ATOM 1246 C GLU A 82 16.285 -0.765 -2.591 1.00 0.18 C ATOM 1247 O GLU A 82 16.012 -1.913 -2.263 1.00 0.30 O ATOM 1248 CB GLU A 82 17.654 -1.426 -4.614 1.00 0.19 C ATOM 1249 CG GLU A 82 18.677 -1.034 -5.696 1.00 0.26 C ATOM 1250 CD GLU A 82 18.399 -1.708 -7.029 1.00 0.86 C ATOM 1251 OE1 GLU A 82 17.372 -1.377 -7.659 1.00 0.78 O ATOM 1252 OE2 GLU A 82 19.204 -2.572 -7.436 1.00 1.75 O ATOM 0 H GLU A 82 18.977 -1.392 -2.203 1.00 0.20 H new ATOM 0 HA GLU A 82 17.430 0.558 -3.831 1.00 0.17 H new ATOM 0 HB2 GLU A 82 17.920 -2.409 -4.226 1.00 0.19 H new ATOM 0 HB3 GLU A 82 16.675 -1.523 -5.083 1.00 0.19 H new ATOM 0 HG2 GLU A 82 18.664 0.048 -5.829 1.00 0.26 H new ATOM 0 HG3 GLU A 82 19.678 -1.301 -5.359 1.00 0.26 H new ATOM 1259 N TYR A 83 15.496 0.279 -2.282 1.00 0.08 N ATOM 1260 CA TYR A 83 14.278 0.129 -1.462 1.00 0.08 C ATOM 1261 C TYR A 83 13.034 0.063 -2.347 1.00 0.08 C ATOM 1262 O TYR A 83 12.823 0.907 -3.205 1.00 0.12 O ATOM 1263 CB TYR A 83 14.152 1.267 -0.433 1.00 0.10 C ATOM 1264 CG TYR A 83 15.207 1.227 0.682 1.00 0.11 C ATOM 1265 CD1 TYR A 83 16.517 1.659 0.452 1.00 0.16 C ATOM 1266 CD2 TYR A 83 14.903 0.752 1.960 1.00 0.17 C ATOM 1267 CE1 TYR A 83 17.471 1.624 1.446 1.00 0.18 C ATOM 1268 CE2 TYR A 83 15.860 0.715 2.955 1.00 0.19 C ATOM 1269 CZ TYR A 83 17.138 1.152 2.693 1.00 0.16 C ATOM 1270 OH TYR A 83 18.088 1.107 3.684 1.00 0.21 O ATOM 0 H TYR A 83 15.679 1.235 -2.587 1.00 0.08 H new ATOM 0 HA TYR A 83 14.361 -0.809 -0.914 1.00 0.08 H new ATOM 0 HB2 TYR A 83 14.226 2.222 -0.953 1.00 0.10 H new ATOM 0 HB3 TYR A 83 13.161 1.225 0.018 1.00 0.10 H new ATOM 0 HD1 TYR A 83 16.787 2.028 -0.526 1.00 0.16 H new ATOM 0 HD2 TYR A 83 13.902 0.408 2.174 1.00 0.17 H new ATOM 0 HE1 TYR A 83 18.476 1.966 1.246 1.00 0.18 H new ATOM 0 HE2 TYR A 83 15.606 0.344 3.937 1.00 0.19 H new ATOM 0 HH TYR A 83 17.689 0.749 4.504 1.00 0.21 H new ATOM 1280 N VAL A 84 12.216 -0.966 -2.125 1.00 0.08 N ATOM 1281 CA VAL A 84 11.006 -1.198 -2.960 1.00 0.10 C ATOM 1282 C VAL A 84 9.717 -0.990 -2.131 1.00 0.10 C ATOM 1283 O VAL A 84 9.493 -1.644 -1.107 1.00 0.10 O ATOM 1284 CB VAL A 84 10.974 -2.640 -3.695 1.00 0.11 C ATOM 1285 CG1 VAL A 84 10.135 -2.628 -5.004 1.00 0.13 C ATOM 1286 CG2 VAL A 84 12.368 -3.197 -4.063 1.00 0.20 C ATOM 0 H VAL A 84 12.355 -1.654 -1.385 1.00 0.08 H new ATOM 0 HA VAL A 84 11.056 -0.455 -3.756 1.00 0.10 H new ATOM 0 HB VAL A 84 10.516 -3.285 -2.945 1.00 0.11 H new ATOM 0 HG11 VAL A 84 10.149 -3.621 -5.454 1.00 0.13 H new ATOM 0 HG12 VAL A 84 9.107 -2.348 -4.775 1.00 0.13 H new ATOM 0 HG13 VAL A 84 10.560 -1.907 -5.702 1.00 0.13 H new ATOM 0 HG21 VAL A 84 12.256 -4.165 -4.551 1.00 0.20 H new ATOM 0 HG22 VAL A 84 12.869 -2.505 -4.740 1.00 0.20 H new ATOM 0 HG23 VAL A 84 12.964 -3.314 -3.158 1.00 0.20 H new ATOM 1296 N LEU A 85 8.879 -0.068 -2.631 1.00 0.12 N ATOM 1297 CA LEU A 85 7.594 0.253 -2.007 1.00 0.15 C ATOM 1298 C LEU A 85 6.433 -0.289 -2.864 1.00 0.16 C ATOM 1299 O LEU A 85 6.107 0.242 -3.933 1.00 0.21 O ATOM 1300 CB LEU A 85 7.491 1.784 -1.790 1.00 0.25 C ATOM 1301 CG LEU A 85 6.456 2.304 -0.735 1.00 0.43 C ATOM 1302 CD1 LEU A 85 7.040 3.422 0.122 1.00 0.78 C ATOM 1303 CD2 LEU A 85 5.179 2.811 -1.395 1.00 0.61 C ATOM 0 H LEU A 85 9.075 0.471 -3.474 1.00 0.12 H new ATOM 0 HA LEU A 85 7.527 -0.230 -1.032 1.00 0.15 H new ATOM 0 HB2 LEU A 85 8.477 2.148 -1.500 1.00 0.25 H new ATOM 0 HB3 LEU A 85 7.251 2.243 -2.749 1.00 0.25 H new ATOM 0 HG LEU A 85 6.217 1.450 -0.101 1.00 0.43 H new ATOM 0 HD11 LEU A 85 6.293 3.757 0.842 1.00 0.78 H new ATOM 0 HD12 LEU A 85 7.917 3.052 0.654 1.00 0.78 H new ATOM 0 HD13 LEU A 85 7.328 4.257 -0.516 1.00 0.78 H new ATOM 0 HD21 LEU A 85 4.488 3.162 -0.629 1.00 0.61 H new ATOM 0 HD22 LEU A 85 5.420 3.632 -2.070 1.00 0.61 H new ATOM 0 HD23 LEU A 85 4.715 2.002 -1.959 1.00 0.61 H new ATOM 1315 N VAL A 86 5.842 -1.384 -2.357 1.00 0.17 N ATOM 1316 CA VAL A 86 4.699 -2.079 -3.003 1.00 0.21 C ATOM 1317 C VAL A 86 3.455 -1.904 -2.089 1.00 0.21 C ATOM 1318 O VAL A 86 3.488 -2.232 -0.893 1.00 0.27 O ATOM 1319 CB VAL A 86 4.931 -3.656 -3.297 1.00 0.25 C ATOM 1320 CG1 VAL A 86 4.030 -4.195 -4.446 1.00 0.44 C ATOM 1321 CG2 VAL A 86 6.395 -4.047 -3.635 1.00 0.32 C ATOM 0 H VAL A 86 6.140 -1.819 -1.484 1.00 0.17 H new ATOM 0 HA VAL A 86 4.569 -1.622 -3.984 1.00 0.21 H new ATOM 0 HB VAL A 86 4.660 -4.116 -2.347 1.00 0.25 H new ATOM 0 HG11 VAL A 86 4.229 -5.256 -4.598 1.00 0.44 H new ATOM 0 HG12 VAL A 86 2.982 -4.057 -4.182 1.00 0.44 H new ATOM 0 HG13 VAL A 86 4.247 -3.650 -5.365 1.00 0.44 H new ATOM 0 HG21 VAL A 86 6.452 -5.120 -3.816 1.00 0.32 H new ATOM 0 HG22 VAL A 86 6.718 -3.511 -4.527 1.00 0.32 H new ATOM 0 HG23 VAL A 86 7.044 -3.785 -2.799 1.00 0.32 H new ATOM 1331 N LEU A 87 2.378 -1.377 -2.672 1.00 0.20 N ATOM 1332 CA LEU A 87 1.136 -1.166 -1.921 1.00 0.22 C ATOM 1333 C LEU A 87 -0.096 -1.617 -2.717 1.00 0.22 C ATOM 1334 O LEU A 87 -0.228 -1.326 -3.919 1.00 0.26 O ATOM 1335 CB LEU A 87 1.018 0.317 -1.422 1.00 0.31 C ATOM 1336 CG LEU A 87 0.605 1.445 -2.422 1.00 0.50 C ATOM 1337 CD1 LEU A 87 0.175 2.690 -1.650 1.00 1.25 C ATOM 1338 CD2 LEU A 87 1.733 1.847 -3.374 1.00 0.88 C ATOM 0 H LEU A 87 2.338 -1.091 -3.650 1.00 0.20 H new ATOM 0 HA LEU A 87 1.175 -1.798 -1.034 1.00 0.22 H new ATOM 0 HB2 LEU A 87 0.297 0.328 -0.604 1.00 0.31 H new ATOM 0 HB3 LEU A 87 1.984 0.595 -1.000 1.00 0.31 H new ATOM 0 HG LEU A 87 -0.214 1.040 -3.017 1.00 0.50 H new ATOM 0 HD11 LEU A 87 -0.112 3.473 -2.352 1.00 1.25 H new ATOM 0 HD12 LEU A 87 -0.674 2.447 -1.011 1.00 1.25 H new ATOM 0 HD13 LEU A 87 1.003 3.041 -1.034 1.00 1.25 H new ATOM 0 HD21 LEU A 87 1.382 2.634 -4.042 1.00 0.88 H new ATOM 0 HD22 LEU A 87 2.583 2.213 -2.797 1.00 0.88 H new ATOM 0 HD23 LEU A 87 2.039 0.981 -3.962 1.00 0.88 H new ATOM 1350 N LYS A 88 -1.007 -2.338 -2.022 1.00 0.23 N ATOM 1351 CA LYS A 88 -2.248 -2.851 -2.657 1.00 0.26 C ATOM 1352 C LYS A 88 -3.442 -1.922 -2.419 1.00 0.27 C ATOM 1353 O LYS A 88 -3.830 -1.649 -1.278 1.00 0.29 O ATOM 1354 CB LYS A 88 -2.615 -4.254 -2.127 1.00 0.31 C ATOM 1355 CG LYS A 88 -3.272 -5.230 -3.139 1.00 0.46 C ATOM 1356 CD LYS A 88 -2.311 -5.784 -4.238 1.00 1.53 C ATOM 1357 CE LYS A 88 -0.928 -6.240 -3.732 1.00 2.13 C ATOM 1358 NZ LYS A 88 -0.292 -7.211 -4.666 1.00 2.52 N ATOM 0 H LYS A 88 -0.910 -2.576 -1.035 1.00 0.23 H new ATOM 0 HA LYS A 88 -2.038 -2.901 -3.725 1.00 0.26 H new ATOM 0 HB2 LYS A 88 -1.708 -4.721 -1.743 1.00 0.31 H new ATOM 0 HB3 LYS A 88 -3.293 -4.132 -1.282 1.00 0.31 H new ATOM 0 HG2 LYS A 88 -3.694 -6.071 -2.589 1.00 0.46 H new ATOM 0 HG3 LYS A 88 -4.102 -4.720 -3.627 1.00 0.46 H new ATOM 0 HD2 LYS A 88 -2.796 -6.627 -4.731 1.00 1.53 H new ATOM 0 HD3 LYS A 88 -2.167 -5.013 -4.994 1.00 1.53 H new ATOM 0 HE2 LYS A 88 -0.280 -5.372 -3.613 1.00 2.13 H new ATOM 0 HE3 LYS A 88 -1.033 -6.697 -2.748 1.00 2.13 H new ATOM 0 HZ1 LYS A 88 0.225 -7.929 -4.120 1.00 2.52 H new ATOM 0 HZ2 LYS A 88 -1.026 -7.674 -5.239 1.00 2.52 H new ATOM 0 HZ3 LYS A 88 0.370 -6.709 -5.292 1.00 2.52 H new ATOM 1372 N PHE A 89 -4.020 -1.450 -3.525 1.00 0.27 N ATOM 1373 CA PHE A 89 -5.194 -0.577 -3.485 1.00 0.29 C ATOM 1374 C PHE A 89 -6.444 -1.355 -3.944 1.00 0.31 C ATOM 1375 O PHE A 89 -6.413 -2.066 -4.960 1.00 0.32 O ATOM 1376 CB PHE A 89 -4.983 0.636 -4.415 1.00 0.30 C ATOM 1377 CG PHE A 89 -4.228 1.823 -3.811 1.00 0.28 C ATOM 1378 CD1 PHE A 89 -4.645 2.456 -2.623 1.00 0.36 C ATOM 1379 CD2 PHE A 89 -3.055 2.280 -4.411 1.00 0.25 C ATOM 1380 CE1 PHE A 89 -3.901 3.480 -2.076 1.00 0.40 C ATOM 1381 CE2 PHE A 89 -2.331 3.317 -3.868 1.00 0.26 C ATOM 1382 CZ PHE A 89 -2.955 4.059 -2.728 1.00 0.31 C ATOM 0 H PHE A 89 -3.690 -1.660 -4.467 1.00 0.27 H new ATOM 0 HA PHE A 89 -5.336 -0.230 -2.462 1.00 0.29 H new ATOM 0 HB2 PHE A 89 -4.443 0.300 -5.300 1.00 0.30 H new ATOM 0 HB3 PHE A 89 -5.959 0.985 -4.751 1.00 0.30 H new ATOM 0 HD1 PHE A 89 -5.555 2.136 -2.137 1.00 0.36 H new ATOM 0 HD2 PHE A 89 -2.708 1.811 -5.320 1.00 0.25 H new ATOM 0 HE1 PHE A 89 -4.119 3.806 -1.070 1.00 0.40 H new ATOM 0 HE2 PHE A 89 -1.356 3.583 -4.248 1.00 0.26 H new ATOM 0 HZ PHE A 89 -2.621 5.051 -2.461 1.00 0.31 H new ATOM 1392 N ALA A 90 -7.559 -1.217 -3.187 1.00 0.33 N ATOM 1393 CA ALA A 90 -8.827 -1.947 -3.517 1.00 0.36 C ATOM 1394 C ALA A 90 -10.095 -1.051 -3.344 1.00 0.39 C ATOM 1395 O ALA A 90 -10.112 -0.093 -2.540 1.00 0.37 O ATOM 1396 CB ALA A 90 -8.957 -3.263 -2.678 1.00 0.41 C ATOM 0 H ALA A 90 -7.617 -0.623 -2.360 1.00 0.33 H new ATOM 0 HA ALA A 90 -8.767 -2.215 -4.572 1.00 0.36 H new ATOM 0 HB1 ALA A 90 -9.886 -3.771 -2.939 1.00 0.41 H new ATOM 0 HB2 ALA A 90 -8.113 -3.917 -2.895 1.00 0.41 H new ATOM 0 HB3 ALA A 90 -8.963 -3.018 -1.616 1.00 0.41 H new ATOM 1402 N GLU A 91 -11.161 -1.390 -4.126 1.00 0.46 N ATOM 1403 CA GLU A 91 -12.471 -0.683 -4.115 1.00 0.53 C ATOM 1404 C GLU A 91 -13.540 -1.432 -3.265 1.00 0.63 C ATOM 1405 O GLU A 91 -13.444 -2.651 -3.060 1.00 1.23 O ATOM 1406 CB GLU A 91 -12.985 -0.512 -5.568 1.00 0.78 C ATOM 1407 CG GLU A 91 -13.030 -1.814 -6.388 1.00 1.80 C ATOM 1408 CD GLU A 91 -13.602 -1.611 -7.773 1.00 2.04 C ATOM 1409 OE1 GLU A 91 -14.839 -1.700 -7.923 1.00 1.94 O ATOM 1410 OE2 GLU A 91 -12.812 -1.360 -8.708 1.00 2.61 O ATOM 0 H GLU A 91 -11.132 -2.168 -4.785 1.00 0.46 H new ATOM 0 HA GLU A 91 -12.312 0.292 -3.655 1.00 0.53 H new ATOM 0 HB2 GLU A 91 -13.986 -0.082 -5.537 1.00 0.78 H new ATOM 0 HB3 GLU A 91 -12.346 0.205 -6.084 1.00 0.78 H new ATOM 0 HG2 GLU A 91 -12.022 -2.221 -6.471 1.00 1.80 H new ATOM 0 HG3 GLU A 91 -13.629 -2.553 -5.856 1.00 1.80 H new ATOM 1417 N VAL A 92 -14.572 -0.702 -2.789 1.00 0.60 N ATOM 1418 CA VAL A 92 -15.624 -1.322 -1.945 1.00 0.76 C ATOM 1419 C VAL A 92 -17.084 -0.733 -2.183 1.00 0.66 C ATOM 1420 O VAL A 92 -18.048 -1.504 -2.182 1.00 1.19 O ATOM 1421 CB VAL A 92 -15.134 -1.375 -0.390 1.00 1.42 C ATOM 1422 CG1 VAL A 92 -15.212 -0.036 0.409 1.00 2.13 C ATOM 1423 CG2 VAL A 92 -15.816 -2.508 0.421 1.00 2.00 C ATOM 0 H VAL A 92 -14.701 0.294 -2.967 1.00 0.60 H new ATOM 0 HA VAL A 92 -15.750 -2.356 -2.267 1.00 0.76 H new ATOM 0 HB VAL A 92 -14.071 -1.590 -0.499 1.00 1.42 H new ATOM 0 HG11 VAL A 92 -14.860 -0.199 1.428 1.00 2.13 H new ATOM 0 HG12 VAL A 92 -14.586 0.714 -0.075 1.00 2.13 H new ATOM 0 HG13 VAL A 92 -16.244 0.314 0.433 1.00 2.13 H new ATOM 0 HG21 VAL A 92 -15.449 -2.492 1.447 1.00 2.00 H new ATOM 0 HG22 VAL A 92 -16.896 -2.358 0.419 1.00 2.00 H new ATOM 0 HG23 VAL A 92 -15.583 -3.471 -0.033 1.00 2.00 H new ATOM 1433 N TYR A 93 -17.233 0.598 -2.380 1.00 0.76 N ATOM 1434 CA TYR A 93 -18.576 1.210 -2.548 1.00 0.80 C ATOM 1435 C TYR A 93 -18.734 2.151 -3.782 1.00 0.86 C ATOM 1436 O TYR A 93 -19.840 2.652 -4.014 1.00 1.46 O ATOM 1437 CB TYR A 93 -18.926 1.984 -1.253 1.00 1.23 C ATOM 1438 CG TYR A 93 -20.432 2.139 -0.963 1.00 0.97 C ATOM 1439 CD1 TYR A 93 -21.208 1.069 -0.492 1.00 1.14 C ATOM 1440 CD2 TYR A 93 -21.078 3.362 -1.169 1.00 1.01 C ATOM 1441 CE1 TYR A 93 -22.563 1.221 -0.240 1.00 1.47 C ATOM 1442 CE2 TYR A 93 -22.433 3.513 -0.914 1.00 1.43 C ATOM 1443 CZ TYR A 93 -23.164 2.401 -0.422 1.00 1.67 C ATOM 1444 OH TYR A 93 -24.511 2.591 -0.202 1.00 2.27 O ATOM 0 H TYR A 93 -16.458 1.259 -2.426 1.00 0.76 H new ATOM 0 HA TYR A 93 -19.264 0.386 -2.737 1.00 0.80 H new ATOM 0 HB2 TYR A 93 -18.461 1.475 -0.409 1.00 1.23 H new ATOM 0 HB3 TYR A 93 -18.480 2.977 -1.311 1.00 1.23 H new ATOM 0 HD1 TYR A 93 -20.741 0.110 -0.323 1.00 1.14 H new ATOM 0 HD2 TYR A 93 -20.511 4.206 -1.534 1.00 1.01 H new ATOM 0 HE1 TYR A 93 -23.139 0.376 0.107 1.00 1.47 H new ATOM 0 HE2 TYR A 93 -22.923 4.460 -1.087 1.00 1.43 H new ATOM 0 HH TYR A 93 -24.745 3.523 -0.393 1.00 2.27 H new ATOM 1454 N PHE A 94 -17.668 2.387 -4.582 1.00 0.78 N ATOM 1455 CA PHE A 94 -17.765 3.287 -5.748 1.00 0.82 C ATOM 1456 C PHE A 94 -17.239 2.633 -7.035 1.00 0.76 C ATOM 1457 O PHE A 94 -16.043 2.346 -7.164 1.00 0.79 O ATOM 1458 CB PHE A 94 -17.010 4.604 -5.481 1.00 1.01 C ATOM 1459 CG PHE A 94 -17.666 5.496 -4.427 1.00 1.11 C ATOM 1460 CD1 PHE A 94 -18.669 6.404 -4.775 1.00 1.31 C ATOM 1461 CD2 PHE A 94 -17.272 5.433 -3.089 1.00 1.13 C ATOM 1462 CE1 PHE A 94 -19.257 7.217 -3.822 1.00 1.46 C ATOM 1463 CE2 PHE A 94 -17.862 6.247 -2.134 1.00 1.23 C ATOM 1464 CZ PHE A 94 -18.881 7.114 -2.497 1.00 1.37 C ATOM 0 H PHE A 94 -16.746 1.973 -4.443 1.00 0.78 H new ATOM 0 HA PHE A 94 -18.824 3.500 -5.896 1.00 0.82 H new ATOM 0 HB2 PHE A 94 -15.994 4.370 -5.162 1.00 1.01 H new ATOM 0 HB3 PHE A 94 -16.931 5.161 -6.415 1.00 1.01 H new ATOM 0 HD1 PHE A 94 -18.990 6.473 -5.804 1.00 1.31 H new ATOM 0 HD2 PHE A 94 -16.497 4.741 -2.794 1.00 1.13 H new ATOM 0 HE1 PHE A 94 -20.011 7.933 -4.115 1.00 1.46 H new ATOM 0 HE2 PHE A 94 -17.528 6.206 -1.108 1.00 1.23 H new ATOM 0 HZ PHE A 94 -19.380 7.708 -1.745 1.00 1.37 H new ATOM 1474 N ALA A 95 -18.171 2.407 -7.996 1.00 0.73 N ATOM 1475 CA ALA A 95 -17.856 1.797 -9.307 1.00 0.73 C ATOM 1476 C ALA A 95 -18.004 2.840 -10.462 1.00 0.72 C ATOM 1477 O ALA A 95 -19.100 3.093 -11.004 1.00 0.84 O ATOM 1478 CB ALA A 95 -18.726 0.527 -9.539 1.00 0.82 C ATOM 0 H ALA A 95 -19.157 2.642 -7.882 1.00 0.73 H new ATOM 0 HA ALA A 95 -16.813 1.480 -9.305 1.00 0.73 H new ATOM 0 HB1 ALA A 95 -18.482 0.091 -10.508 1.00 0.82 H new ATOM 0 HB2 ALA A 95 -18.525 -0.200 -8.752 1.00 0.82 H new ATOM 0 HB3 ALA A 95 -19.781 0.800 -9.520 1.00 0.82 H new ATOM 1484 N GLN A 96 -16.871 3.492 -10.783 1.00 0.65 N ATOM 1485 CA GLN A 96 -16.807 4.519 -11.851 1.00 0.66 C ATOM 1486 C GLN A 96 -15.405 4.609 -12.486 1.00 0.58 C ATOM 1487 O GLN A 96 -14.385 4.378 -11.824 1.00 0.53 O ATOM 1488 CB GLN A 96 -17.199 5.907 -11.298 1.00 0.72 C ATOM 1489 CG GLN A 96 -18.701 6.231 -11.366 1.00 1.40 C ATOM 1490 CD GLN A 96 -19.068 7.508 -10.631 1.00 1.85 C ATOM 1491 OE1 GLN A 96 -20.166 7.628 -10.088 1.00 2.38 O ATOM 1492 NE2 GLN A 96 -18.156 8.475 -10.614 1.00 2.45 N ATOM 0 H GLN A 96 -15.979 3.327 -10.317 1.00 0.65 H new ATOM 0 HA GLN A 96 -17.515 4.213 -12.621 1.00 0.66 H new ATOM 0 HB2 GLN A 96 -16.875 5.973 -10.259 1.00 0.72 H new ATOM 0 HB3 GLN A 96 -16.652 6.670 -11.852 1.00 0.72 H new ATOM 0 HG2 GLN A 96 -19.000 6.321 -12.410 1.00 1.40 H new ATOM 0 HG3 GLN A 96 -19.266 5.400 -10.943 1.00 1.40 H new ATOM 0 HE21 GLN A 96 -17.257 8.337 -11.076 1.00 2.45 H new ATOM 0 HE22 GLN A 96 -18.355 9.355 -10.139 1.00 2.45 H new ATOM 1501 N SER A 97 -15.367 4.979 -13.783 1.00 0.64 N ATOM 1502 CA SER A 97 -14.101 5.107 -14.532 1.00 0.62 C ATOM 1503 C SER A 97 -13.919 6.502 -15.149 1.00 0.81 C ATOM 1504 O SER A 97 -14.704 6.936 -16.001 1.00 1.66 O ATOM 1505 CB SER A 97 -14.017 4.051 -15.640 1.00 0.68 C ATOM 1506 OG SER A 97 -13.680 2.775 -15.124 1.00 0.73 O ATOM 0 H SER A 97 -16.199 5.194 -14.333 1.00 0.64 H new ATOM 0 HA SER A 97 -13.300 4.952 -13.809 1.00 0.62 H new ATOM 0 HB2 SER A 97 -14.973 3.992 -16.160 1.00 0.68 H new ATOM 0 HB3 SER A 97 -13.272 4.354 -16.376 1.00 0.68 H new ATOM 0 HG SER A 97 -13.637 2.126 -15.857 1.00 0.73 H new ATOM 1512 N GLN A 98 -12.841 7.189 -14.688 1.00 0.55 N ATOM 1513 CA GLN A 98 -12.428 8.575 -15.099 1.00 0.54 C ATOM 1514 C GLN A 98 -13.379 9.685 -14.549 1.00 0.56 C ATOM 1515 O GLN A 98 -13.930 10.502 -15.294 1.00 0.67 O ATOM 1516 CB GLN A 98 -12.236 8.695 -16.638 1.00 0.62 C ATOM 1517 CG GLN A 98 -11.311 9.848 -17.080 1.00 1.06 C ATOM 1518 CD GLN A 98 -10.969 9.810 -18.560 1.00 1.14 C ATOM 1519 OE1 GLN A 98 -11.771 9.387 -19.395 1.00 1.89 O ATOM 1520 NE2 GLN A 98 -9.761 10.253 -18.887 1.00 1.60 N ATOM 0 H GLN A 98 -12.208 6.787 -13.996 1.00 0.55 H new ATOM 0 HA GLN A 98 -11.457 8.746 -14.634 1.00 0.54 H new ATOM 0 HB2 GLN A 98 -11.831 7.756 -17.015 1.00 0.62 H new ATOM 0 HB3 GLN A 98 -13.212 8.830 -17.104 1.00 0.62 H new ATOM 0 HG2 GLN A 98 -11.791 10.799 -16.849 1.00 1.06 H new ATOM 0 HG3 GLN A 98 -10.389 9.808 -16.500 1.00 1.06 H new ATOM 0 HE21 GLN A 98 -9.130 10.594 -18.162 1.00 1.60 H new ATOM 0 HE22 GLN A 98 -9.464 10.252 -19.863 1.00 1.60 H new ATOM 1529 N GLN A 99 -13.533 9.666 -13.221 1.00 0.53 N ATOM 1530 CA GLN A 99 -14.390 10.594 -12.455 1.00 0.58 C ATOM 1531 C GLN A 99 -13.862 10.713 -11.013 1.00 0.57 C ATOM 1532 O GLN A 99 -13.851 11.805 -10.441 1.00 0.62 O ATOM 1533 CB GLN A 99 -15.860 10.119 -12.435 1.00 0.61 C ATOM 1534 CG GLN A 99 -16.685 10.515 -13.669 1.00 1.18 C ATOM 1535 CD GLN A 99 -18.071 9.897 -13.663 1.00 1.71 C ATOM 1536 OE1 GLN A 99 -18.278 8.806 -14.196 1.00 2.56 O ATOM 1537 NE2 GLN A 99 -19.028 10.592 -13.059 1.00 2.02 N ATOM 0 H GLN A 99 -13.054 8.988 -12.628 1.00 0.53 H new ATOM 0 HA GLN A 99 -14.358 11.568 -12.944 1.00 0.58 H new ATOM 0 HB2 GLN A 99 -15.874 9.033 -12.340 1.00 0.61 H new ATOM 0 HB3 GLN A 99 -16.345 10.523 -11.547 1.00 0.61 H new ATOM 0 HG2 GLN A 99 -16.775 11.601 -13.709 1.00 1.18 H new ATOM 0 HG3 GLN A 99 -16.156 10.205 -14.570 1.00 1.18 H new ATOM 0 HE21 GLN A 99 -18.812 11.492 -12.630 1.00 2.02 H new ATOM 0 HE22 GLN A 99 -19.979 10.226 -13.024 1.00 2.02 H new ATOM 1546 N LYS A 100 -13.422 9.560 -10.431 1.00 0.53 N ATOM 1547 CA LYS A 100 -12.830 9.514 -9.084 1.00 0.55 C ATOM 1548 C LYS A 100 -11.314 9.267 -9.220 1.00 0.48 C ATOM 1549 O LYS A 100 -10.822 8.145 -9.064 1.00 0.49 O ATOM 1550 CB LYS A 100 -13.491 8.410 -8.226 1.00 0.64 C ATOM 1551 CG LYS A 100 -14.666 8.877 -7.329 1.00 1.11 C ATOM 1552 CD LYS A 100 -15.886 9.370 -8.141 1.00 1.52 C ATOM 1553 CE LYS A 100 -17.051 9.813 -7.241 1.00 2.14 C ATOM 1554 NZ LYS A 100 -18.204 10.310 -8.042 1.00 2.76 N ATOM 0 H LYS A 100 -13.472 8.650 -10.888 1.00 0.53 H new ATOM 0 HA LYS A 100 -13.003 10.464 -8.578 1.00 0.55 H new ATOM 0 HB2 LYS A 100 -13.853 7.626 -8.891 1.00 0.64 H new ATOM 0 HB3 LYS A 100 -12.727 7.962 -7.590 1.00 0.64 H new ATOM 0 HG2 LYS A 100 -14.974 8.053 -6.685 1.00 1.11 H new ATOM 0 HG3 LYS A 100 -14.322 9.680 -6.677 1.00 1.11 H new ATOM 0 HD2 LYS A 100 -15.584 10.203 -8.775 1.00 1.52 H new ATOM 0 HD3 LYS A 100 -16.225 8.573 -8.802 1.00 1.52 H new ATOM 0 HE2 LYS A 100 -17.372 8.976 -6.621 1.00 2.14 H new ATOM 0 HE3 LYS A 100 -16.711 10.598 -6.565 1.00 2.14 H new ATOM 0 HZ1 LYS A 100 -18.720 11.031 -7.498 1.00 2.76 H new ATOM 0 HZ2 LYS A 100 -17.856 10.728 -8.928 1.00 2.76 H new ATOM 0 HZ3 LYS A 100 -18.842 9.518 -8.260 1.00 2.76 H new ATOM 1568 N VAL A 101 -10.591 10.364 -9.506 1.00 0.45 N ATOM 1569 CA VAL A 101 -9.121 10.340 -9.740 1.00 0.40 C ATOM 1570 C VAL A 101 -8.347 10.991 -8.561 1.00 0.41 C ATOM 1571 O VAL A 101 -8.639 12.117 -8.140 1.00 0.47 O ATOM 1572 CB VAL A 101 -8.655 10.970 -11.144 1.00 0.38 C ATOM 1573 CG1 VAL A 101 -8.568 9.892 -12.245 1.00 0.69 C ATOM 1574 CG2 VAL A 101 -9.527 12.141 -11.687 1.00 0.68 C ATOM 0 H VAL A 101 -11.001 11.295 -9.583 1.00 0.45 H new ATOM 0 HA VAL A 101 -8.866 9.282 -9.795 1.00 0.40 H new ATOM 0 HB VAL A 101 -7.676 11.388 -10.911 1.00 0.38 H new ATOM 0 HG11 VAL A 101 -8.250 10.352 -13.181 1.00 0.69 H new ATOM 0 HG12 VAL A 101 -7.846 9.130 -11.952 1.00 0.69 H new ATOM 0 HG13 VAL A 101 -9.546 9.431 -12.381 1.00 0.69 H new ATOM 0 HG21 VAL A 101 -9.120 12.487 -12.637 1.00 0.68 H new ATOM 0 HG22 VAL A 101 -10.550 11.795 -11.835 1.00 0.68 H new ATOM 0 HG23 VAL A 101 -9.522 12.962 -10.970 1.00 0.68 H new ATOM 1584 N PHE A 102 -7.343 10.250 -8.064 1.00 0.39 N ATOM 1585 CA PHE A 102 -6.543 10.656 -6.883 1.00 0.40 C ATOM 1586 C PHE A 102 -5.048 10.927 -7.168 1.00 0.38 C ATOM 1587 O PHE A 102 -4.547 10.669 -8.262 1.00 0.41 O ATOM 1588 CB PHE A 102 -6.627 9.511 -5.862 1.00 0.42 C ATOM 1589 CG PHE A 102 -8.055 9.107 -5.482 1.00 0.49 C ATOM 1590 CD1 PHE A 102 -8.953 10.044 -4.976 1.00 0.60 C ATOM 1591 CD2 PHE A 102 -8.515 7.796 -5.675 1.00 0.60 C ATOM 1592 CE1 PHE A 102 -10.255 9.689 -4.676 1.00 0.67 C ATOM 1593 CE2 PHE A 102 -9.814 7.443 -5.366 1.00 0.70 C ATOM 1594 CZ PHE A 102 -10.685 8.389 -4.870 1.00 0.69 C ATOM 0 H PHE A 102 -7.059 9.355 -8.463 1.00 0.39 H new ATOM 0 HA PHE A 102 -6.960 11.599 -6.530 1.00 0.40 H new ATOM 0 HB2 PHE A 102 -6.112 8.640 -6.267 1.00 0.42 H new ATOM 0 HB3 PHE A 102 -6.093 9.806 -4.959 1.00 0.42 H new ATOM 0 HD1 PHE A 102 -8.628 11.061 -4.816 1.00 0.60 H new ATOM 0 HD2 PHE A 102 -7.842 7.050 -6.072 1.00 0.60 H new ATOM 0 HE1 PHE A 102 -10.939 10.430 -4.289 1.00 0.67 H new ATOM 0 HE2 PHE A 102 -10.147 6.426 -5.513 1.00 0.70 H new ATOM 0 HZ PHE A 102 -11.703 8.115 -4.633 1.00 0.69 H new ATOM 1604 N ASP A 103 -4.331 11.466 -6.146 1.00 0.36 N ATOM 1605 CA ASP A 103 -2.874 11.723 -6.275 1.00 0.34 C ATOM 1606 C ASP A 103 -2.058 10.914 -5.249 1.00 0.32 C ATOM 1607 O ASP A 103 -2.407 10.836 -4.065 1.00 0.34 O ATOM 1608 CB ASP A 103 -2.514 13.215 -6.176 1.00 0.37 C ATOM 1609 CG ASP A 103 -2.781 14.012 -7.453 1.00 0.85 C ATOM 1610 OD1 ASP A 103 -3.812 13.756 -8.110 1.00 1.30 O ATOM 1611 OD2 ASP A 103 -1.958 14.890 -7.788 1.00 1.33 O ATOM 0 H ASP A 103 -4.729 11.726 -5.243 1.00 0.36 H new ATOM 0 HA ASP A 103 -2.607 11.389 -7.278 1.00 0.34 H new ATOM 0 HB2 ASP A 103 -3.081 13.660 -5.358 1.00 0.37 H new ATOM 0 HB3 ASP A 103 -1.459 13.306 -5.919 1.00 0.37 H new ATOM 1616 N VAL A 104 -0.947 10.323 -5.733 1.00 0.29 N ATOM 1617 CA VAL A 104 -0.064 9.442 -4.918 1.00 0.28 C ATOM 1618 C VAL A 104 1.432 9.923 -5.029 1.00 0.26 C ATOM 1619 O VAL A 104 2.007 9.954 -6.138 1.00 0.25 O ATOM 1620 CB VAL A 104 -0.282 7.884 -5.347 1.00 0.33 C ATOM 1621 CG1 VAL A 104 0.724 6.869 -4.734 1.00 0.31 C ATOM 1622 CG2 VAL A 104 -1.669 7.362 -4.962 1.00 0.48 C ATOM 0 H VAL A 104 -0.631 10.438 -6.696 1.00 0.29 H new ATOM 0 HA VAL A 104 -0.331 9.512 -3.864 1.00 0.28 H new ATOM 0 HB VAL A 104 -0.133 7.929 -6.426 1.00 0.33 H new ATOM 0 HG11 VAL A 104 0.487 5.865 -5.085 1.00 0.31 H new ATOM 0 HG12 VAL A 104 1.737 7.131 -5.040 1.00 0.31 H new ATOM 0 HG13 VAL A 104 0.654 6.899 -3.647 1.00 0.31 H new ATOM 0 HG21 VAL A 104 -1.764 6.321 -5.269 1.00 0.48 H new ATOM 0 HG22 VAL A 104 -1.798 7.435 -3.882 1.00 0.48 H new ATOM 0 HG23 VAL A 104 -2.433 7.958 -5.460 1.00 0.48 H new ATOM 1632 N ARG A 105 2.041 10.215 -3.841 1.00 0.26 N ATOM 1633 CA ARG A 105 3.445 10.703 -3.742 1.00 0.26 C ATOM 1634 C ARG A 105 4.337 9.933 -2.728 1.00 0.23 C ATOM 1635 O ARG A 105 3.869 9.433 -1.697 1.00 0.26 O ATOM 1636 CB ARG A 105 3.522 12.215 -3.345 1.00 0.33 C ATOM 1637 CG ARG A 105 2.182 12.946 -3.075 1.00 0.53 C ATOM 1638 CD ARG A 105 2.405 14.424 -2.680 1.00 0.51 C ATOM 1639 NE ARG A 105 1.295 14.966 -1.903 1.00 0.92 N ATOM 1640 CZ ARG A 105 1.340 16.143 -1.279 1.00 1.25 C ATOM 1641 NH1 ARG A 105 2.421 16.908 -1.373 1.00 1.15 N ATOM 1642 NH2 ARG A 105 0.304 16.559 -0.563 1.00 1.69 N ATOM 0 H ARG A 105 1.576 10.119 -2.938 1.00 0.26 H new ATOM 0 HA ARG A 105 3.828 10.531 -4.748 1.00 0.26 H new ATOM 0 HB2 ARG A 105 4.138 12.298 -2.450 1.00 0.33 H new ATOM 0 HB3 ARG A 105 4.043 12.747 -4.141 1.00 0.33 H new ATOM 0 HG2 ARG A 105 1.556 12.898 -3.966 1.00 0.53 H new ATOM 0 HG3 ARG A 105 1.643 12.434 -2.278 1.00 0.53 H new ATOM 0 HD2 ARG A 105 3.325 14.508 -2.101 1.00 0.51 H new ATOM 0 HD3 ARG A 105 2.540 15.022 -3.581 1.00 0.51 H new ATOM 0 HE ARG A 105 0.439 14.415 -1.834 1.00 0.92 H new ATOM 0 HH11 ARG A 105 3.220 16.596 -1.924 1.00 1.15 H new ATOM 0 HH12 ARG A 105 2.452 17.808 -0.894 1.00 1.15 H new ATOM 0 HH21 ARG A 105 -0.531 15.978 -0.488 1.00 1.69 H new ATOM 0 HH22 ARG A 105 0.342 17.460 -0.087 1.00 1.69 H new ATOM 1656 N VAL A 106 5.658 9.882 -3.058 1.00 0.23 N ATOM 1657 CA VAL A 106 6.720 9.252 -2.204 1.00 0.23 C ATOM 1658 C VAL A 106 7.903 10.241 -1.927 1.00 0.22 C ATOM 1659 O VAL A 106 8.698 10.550 -2.821 1.00 0.23 O ATOM 1660 CB VAL A 106 7.295 7.839 -2.702 1.00 0.29 C ATOM 1661 CG1 VAL A 106 6.438 6.672 -2.186 1.00 0.57 C ATOM 1662 CG2 VAL A 106 7.464 7.683 -4.237 1.00 0.60 C ATOM 0 H VAL A 106 6.023 10.276 -3.925 1.00 0.23 H new ATOM 0 HA VAL A 106 6.186 9.028 -1.281 1.00 0.23 H new ATOM 0 HB VAL A 106 8.298 7.813 -2.276 1.00 0.29 H new ATOM 0 HG11 VAL A 106 6.855 5.730 -2.541 1.00 0.57 H new ATOM 0 HG12 VAL A 106 6.433 6.678 -1.096 1.00 0.57 H new ATOM 0 HG13 VAL A 106 5.418 6.779 -2.554 1.00 0.57 H new ATOM 0 HG21 VAL A 106 7.858 6.692 -4.461 1.00 0.60 H new ATOM 0 HG22 VAL A 106 6.497 7.807 -4.724 1.00 0.60 H new ATOM 0 HG23 VAL A 106 8.156 8.440 -4.606 1.00 0.60 H new ATOM 1672 N ASN A 107 7.983 10.730 -0.644 1.00 0.23 N ATOM 1673 CA ASN A 107 8.995 11.736 -0.114 1.00 0.23 C ATOM 1674 C ASN A 107 8.860 13.148 -0.765 1.00 0.24 C ATOM 1675 O ASN A 107 9.827 13.918 -0.820 1.00 0.25 O ATOM 1676 CB ASN A 107 10.453 11.238 -0.273 1.00 0.23 C ATOM 1677 CG ASN A 107 11.290 11.338 0.999 1.00 0.27 C ATOM 1678 OD1 ASN A 107 12.129 10.483 1.273 1.00 1.05 O ATOM 1679 ND2 ASN A 107 11.083 12.406 1.761 1.00 1.12 N ATOM 0 H ASN A 107 7.328 10.431 0.079 1.00 0.23 H new ATOM 0 HA ASN A 107 8.763 11.831 0.947 1.00 0.23 H new ATOM 0 HB2 ASN A 107 10.436 10.199 -0.603 1.00 0.23 H new ATOM 0 HB3 ASN A 107 10.938 11.815 -1.060 1.00 0.23 H new ATOM 0 HD21 ASN A 107 11.631 12.540 2.611 1.00 1.12 H new ATOM 0 HD22 ASN A 107 10.376 13.092 1.496 1.00 1.12 H new ATOM 1686 N GLY A 108 7.643 13.469 -1.237 1.00 0.25 N ATOM 1687 CA GLY A 108 7.397 14.724 -1.922 1.00 0.29 C ATOM 1688 C GLY A 108 7.259 14.590 -3.463 1.00 0.29 C ATOM 1689 O GLY A 108 6.801 15.519 -4.133 1.00 0.32 O ATOM 0 H GLY A 108 6.823 12.869 -1.151 1.00 0.25 H new ATOM 0 HA2 GLY A 108 6.486 15.170 -1.524 1.00 0.29 H new ATOM 0 HA3 GLY A 108 8.212 15.413 -1.700 1.00 0.29 H new ATOM 1693 N HIS A 109 7.669 13.407 -4.001 1.00 0.27 N ATOM 1694 CA HIS A 109 7.657 13.071 -5.434 1.00 0.28 C ATOM 1695 C HIS A 109 6.341 12.417 -5.917 1.00 0.30 C ATOM 1696 O HIS A 109 5.895 11.446 -5.331 1.00 0.57 O ATOM 1697 CB HIS A 109 8.766 12.041 -5.637 1.00 0.29 C ATOM 1698 CG HIS A 109 10.169 12.559 -5.503 1.00 0.31 C ATOM 1699 ND1 HIS A 109 10.909 13.012 -6.573 1.00 0.43 N ATOM 1700 CD2 HIS A 109 10.978 12.664 -4.415 1.00 0.27 C ATOM 1701 CE1 HIS A 109 12.109 13.370 -6.157 1.00 0.46 C ATOM 1702 NE2 HIS A 109 12.176 13.170 -4.852 1.00 0.36 N ATOM 0 H HIS A 109 8.026 12.646 -3.423 1.00 0.27 H new ATOM 0 HA HIS A 109 7.781 13.996 -5.997 1.00 0.28 H new ATOM 0 HB2 HIS A 109 8.625 11.236 -4.916 1.00 0.29 H new ATOM 0 HB3 HIS A 109 8.653 11.604 -6.629 1.00 0.29 H new ATOM 0 HD1 HIS A 109 10.580 13.063 -7.537 1.00 0.43 H new ATOM 0 HD2 HIS A 109 10.725 12.399 -3.399 1.00 0.27 H new ATOM 0 HE1 HIS A 109 12.902 13.760 -6.778 1.00 0.46 H new ATOM 1711 N THR A 110 5.748 12.902 -7.029 1.00 0.31 N ATOM 1712 CA THR A 110 4.490 12.283 -7.549 1.00 0.32 C ATOM 1713 C THR A 110 4.748 11.282 -8.693 1.00 0.35 C ATOM 1714 O THR A 110 5.380 11.602 -9.706 1.00 0.47 O ATOM 1715 CB THR A 110 3.374 13.277 -8.014 1.00 0.43 C ATOM 1716 OG1 THR A 110 3.921 14.464 -8.624 1.00 0.55 O ATOM 1717 CG2 THR A 110 2.421 13.676 -6.870 1.00 0.47 C ATOM 0 H THR A 110 6.097 13.691 -7.574 1.00 0.31 H new ATOM 0 HA THR A 110 4.112 11.771 -6.664 1.00 0.32 H new ATOM 0 HB THR A 110 2.798 12.734 -8.763 1.00 0.43 H new ATOM 0 HG1 THR A 110 3.191 15.056 -8.901 1.00 0.55 H new ATOM 0 HG21 THR A 110 1.667 14.366 -7.249 1.00 0.47 H new ATOM 0 HG22 THR A 110 1.932 12.785 -6.476 1.00 0.47 H new ATOM 0 HG23 THR A 110 2.989 14.159 -6.075 1.00 0.47 H new ATOM 1725 N VAL A 111 4.222 10.067 -8.489 1.00 0.29 N ATOM 1726 CA VAL A 111 4.353 8.943 -9.458 1.00 0.35 C ATOM 1727 C VAL A 111 2.975 8.620 -10.096 1.00 0.35 C ATOM 1728 O VAL A 111 2.885 8.493 -11.321 1.00 0.39 O ATOM 1729 CB VAL A 111 4.963 7.574 -8.867 1.00 0.38 C ATOM 1730 CG1 VAL A 111 5.881 6.871 -9.901 1.00 1.06 C ATOM 1731 CG2 VAL A 111 5.770 7.732 -7.561 1.00 1.00 C ATOM 0 H VAL A 111 3.692 9.824 -7.652 1.00 0.29 H new ATOM 0 HA VAL A 111 5.073 9.309 -10.190 1.00 0.35 H new ATOM 0 HB VAL A 111 4.080 6.976 -8.642 1.00 0.38 H new ATOM 0 HG11 VAL A 111 6.276 5.951 -9.471 1.00 1.06 H new ATOM 0 HG12 VAL A 111 5.306 6.635 -10.797 1.00 1.06 H new ATOM 0 HG13 VAL A 111 6.707 7.532 -10.163 1.00 1.06 H new ATOM 0 HG21 VAL A 111 6.140 6.758 -7.242 1.00 1.00 H new ATOM 0 HG22 VAL A 111 6.613 8.401 -7.733 1.00 1.00 H new ATOM 0 HG23 VAL A 111 5.128 8.149 -6.785 1.00 1.00 H new ATOM 1741 N VAL A 112 1.913 8.486 -9.265 1.00 0.33 N ATOM 1742 CA VAL A 112 0.571 8.162 -9.812 1.00 0.35 C ATOM 1743 C VAL A 112 -0.420 9.298 -9.471 1.00 0.34 C ATOM 1744 O VAL A 112 -1.107 9.247 -8.452 1.00 0.32 O ATOM 1745 CB VAL A 112 -0.056 6.729 -9.370 1.00 0.37 C ATOM 1746 CG1 VAL A 112 -0.621 5.966 -10.592 1.00 0.44 C ATOM 1747 CG2 VAL A 112 0.915 5.767 -8.631 1.00 0.40 C ATOM 0 H VAL A 112 1.952 8.592 -8.251 1.00 0.33 H new ATOM 0 HA VAL A 112 0.725 8.073 -10.887 1.00 0.35 H new ATOM 0 HB VAL A 112 -0.836 7.008 -8.662 1.00 0.37 H new ATOM 0 HG11 VAL A 112 -1.034 5.011 -10.266 1.00 0.44 H new ATOM 0 HG12 VAL A 112 -1.406 6.560 -11.060 1.00 0.44 H new ATOM 0 HG13 VAL A 112 0.178 5.789 -11.312 1.00 0.44 H new ATOM 0 HG21 VAL A 112 0.393 4.843 -8.383 1.00 0.40 H new ATOM 0 HG22 VAL A 112 1.765 5.542 -9.275 1.00 0.40 H new ATOM 0 HG23 VAL A 112 1.269 6.240 -7.715 1.00 0.40 H new ATOM 1757 N LYS A 113 -0.499 10.315 -10.370 1.00 0.36 N ATOM 1758 CA LYS A 113 -1.429 11.439 -10.183 1.00 0.38 C ATOM 1759 C LYS A 113 -2.589 11.382 -11.192 1.00 0.43 C ATOM 1760 O LYS A 113 -2.727 12.188 -12.119 1.00 0.70 O ATOM 1761 CB LYS A 113 -0.693 12.799 -10.232 1.00 0.42 C ATOM 1762 CG LYS A 113 -0.040 13.162 -11.610 1.00 1.12 C ATOM 1763 CD LYS A 113 1.500 13.184 -11.581 1.00 1.27 C ATOM 1764 CE LYS A 113 2.127 11.779 -11.604 1.00 1.50 C ATOM 1765 NZ LYS A 113 1.796 11.041 -12.856 1.00 2.30 N ATOM 0 H LYS A 113 0.066 10.372 -11.217 1.00 0.36 H new ATOM 0 HA LYS A 113 -1.862 11.344 -9.187 1.00 0.38 H new ATOM 0 HB2 LYS A 113 -1.400 13.585 -9.966 1.00 0.42 H new ATOM 0 HB3 LYS A 113 0.086 12.799 -9.469 1.00 0.42 H new ATOM 0 HG2 LYS A 113 -0.370 12.442 -12.359 1.00 1.12 H new ATOM 0 HG3 LYS A 113 -0.402 14.140 -11.927 1.00 1.12 H new ATOM 0 HD2 LYS A 113 1.865 13.752 -12.437 1.00 1.27 H new ATOM 0 HD3 LYS A 113 1.833 13.709 -10.685 1.00 1.27 H new ATOM 0 HE2 LYS A 113 3.209 11.863 -11.508 1.00 1.50 H new ATOM 0 HE3 LYS A 113 1.774 11.210 -10.744 1.00 1.50 H new ATOM 0 HZ1 LYS A 113 1.328 10.144 -12.617 1.00 2.30 H new ATOM 0 HZ2 LYS A 113 1.159 11.618 -13.441 1.00 2.30 H new ATOM 0 HZ3 LYS A 113 2.670 10.845 -13.385 1.00 2.30 H new ATOM 1779 N ASP A 114 -3.428 10.407 -10.894 1.00 0.37 N ATOM 1780 CA ASP A 114 -4.665 10.020 -11.617 1.00 0.42 C ATOM 1781 C ASP A 114 -5.030 8.560 -11.225 1.00 0.38 C ATOM 1782 O ASP A 114 -5.105 7.675 -12.086 1.00 0.40 O ATOM 1783 CB ASP A 114 -4.646 10.227 -13.210 1.00 0.50 C ATOM 1784 CG ASP A 114 -3.508 9.548 -14.027 1.00 1.70 C ATOM 1785 OD1 ASP A 114 -3.683 8.380 -14.432 1.00 2.48 O ATOM 1786 OD2 ASP A 114 -2.466 10.199 -14.250 1.00 2.09 O ATOM 0 H ASP A 114 -3.267 9.810 -10.083 1.00 0.37 H new ATOM 0 HA ASP A 114 -5.440 10.717 -11.297 1.00 0.42 H new ATOM 0 HB2 ASP A 114 -5.597 9.869 -13.604 1.00 0.50 H new ATOM 0 HB3 ASP A 114 -4.603 11.298 -13.406 1.00 0.50 H new ATOM 1791 N LEU A 115 -5.280 8.305 -9.908 1.00 0.36 N ATOM 1792 CA LEU A 115 -5.604 6.946 -9.460 1.00 0.36 C ATOM 1793 C LEU A 115 -7.109 6.645 -9.437 1.00 0.38 C ATOM 1794 O LEU A 115 -7.857 7.101 -8.570 1.00 0.42 O ATOM 1795 CB LEU A 115 -4.981 6.553 -8.102 1.00 0.38 C ATOM 1796 CG LEU A 115 -4.107 5.235 -8.060 1.00 0.35 C ATOM 1797 CD1 LEU A 115 -3.927 4.763 -6.648 1.00 1.13 C ATOM 1798 CD2 LEU A 115 -4.647 4.038 -8.860 1.00 1.06 C ATOM 0 H LEU A 115 -5.261 9.008 -9.169 1.00 0.36 H new ATOM 0 HA LEU A 115 -5.140 6.326 -10.227 1.00 0.36 H new ATOM 0 HB2 LEU A 115 -4.359 7.382 -7.764 1.00 0.38 H new ATOM 0 HB3 LEU A 115 -5.789 6.445 -7.378 1.00 0.38 H new ATOM 0 HG LEU A 115 -3.174 5.545 -8.530 1.00 0.35 H new ATOM 0 HD11 LEU A 115 -3.323 3.856 -6.642 1.00 1.13 H new ATOM 0 HD12 LEU A 115 -3.425 5.537 -6.067 1.00 1.13 H new ATOM 0 HD13 LEU A 115 -4.902 4.553 -6.207 1.00 1.13 H new ATOM 0 HD21 LEU A 115 -3.965 3.194 -8.756 1.00 1.06 H new ATOM 0 HD22 LEU A 115 -5.630 3.760 -8.479 1.00 1.06 H new ATOM 0 HD23 LEU A 115 -4.729 4.311 -9.912 1.00 1.06 H new ATOM 1810 N ASP A 116 -7.504 5.897 -10.468 1.00 0.39 N ATOM 1811 CA ASP A 116 -8.855 5.380 -10.644 1.00 0.43 C ATOM 1812 C ASP A 116 -8.725 3.839 -10.659 1.00 0.42 C ATOM 1813 O ASP A 116 -8.322 3.247 -11.674 1.00 0.43 O ATOM 1814 CB ASP A 116 -9.475 5.919 -11.950 1.00 0.46 C ATOM 1815 CG ASP A 116 -10.970 6.215 -11.837 1.00 1.55 C ATOM 1816 OD1 ASP A 116 -11.746 5.261 -11.630 1.00 2.35 O ATOM 1817 OD2 ASP A 116 -11.353 7.398 -11.954 1.00 1.83 O ATOM 0 H ASP A 116 -6.873 5.629 -11.223 1.00 0.39 H new ATOM 0 HA ASP A 116 -9.520 5.699 -9.841 1.00 0.43 H new ATOM 0 HB2 ASP A 116 -8.953 6.830 -12.242 1.00 0.46 H new ATOM 0 HB3 ASP A 116 -9.316 5.192 -12.746 1.00 0.46 H new ATOM 1822 N ILE A 117 -9.088 3.196 -9.518 1.00 0.42 N ATOM 1823 CA ILE A 117 -8.947 1.714 -9.321 1.00 0.42 C ATOM 1824 C ILE A 117 -9.906 0.835 -10.227 1.00 0.44 C ATOM 1825 O ILE A 117 -9.545 -0.291 -10.586 1.00 0.44 O ATOM 1826 CB ILE A 117 -9.085 1.282 -7.790 1.00 0.43 C ATOM 1827 CG1 ILE A 117 -8.903 2.477 -6.801 1.00 0.55 C ATOM 1828 CG2 ILE A 117 -8.063 0.167 -7.414 1.00 0.49 C ATOM 1829 CD1 ILE A 117 -10.177 2.922 -6.087 1.00 0.68 C ATOM 0 H ILE A 117 -9.484 3.678 -8.711 1.00 0.42 H new ATOM 0 HA ILE A 117 -7.930 1.504 -9.653 1.00 0.42 H new ATOM 0 HB ILE A 117 -10.102 0.903 -7.690 1.00 0.43 H new ATOM 0 HG12 ILE A 117 -8.162 2.199 -6.051 1.00 0.55 H new ATOM 0 HG13 ILE A 117 -8.497 3.326 -7.351 1.00 0.55 H new ATOM 0 HG21 ILE A 117 -8.187 -0.101 -6.365 1.00 0.49 H new ATOM 0 HG22 ILE A 117 -8.237 -0.711 -8.036 1.00 0.49 H new ATOM 0 HG23 ILE A 117 -7.049 0.532 -7.578 1.00 0.49 H new ATOM 0 HD11 ILE A 117 -9.950 3.756 -5.423 1.00 0.68 H new ATOM 0 HD12 ILE A 117 -10.916 3.236 -6.824 1.00 0.68 H new ATOM 0 HD13 ILE A 117 -10.576 2.092 -5.504 1.00 0.68 H new ATOM 1841 N PHE A 118 -11.086 1.392 -10.636 1.00 0.48 N ATOM 1842 CA PHE A 118 -12.067 0.697 -11.527 1.00 0.51 C ATOM 1843 C PHE A 118 -11.606 0.692 -13.025 1.00 0.53 C ATOM 1844 O PHE A 118 -11.800 -0.301 -13.729 1.00 0.56 O ATOM 1845 CB PHE A 118 -13.454 1.365 -11.396 1.00 0.56 C ATOM 1846 CG PHE A 118 -14.625 0.540 -11.942 1.00 0.62 C ATOM 1847 CD1 PHE A 118 -15.146 -0.521 -11.206 1.00 0.65 C ATOM 1848 CD2 PHE A 118 -15.201 0.822 -13.185 1.00 0.68 C ATOM 1849 CE1 PHE A 118 -16.203 -1.275 -11.688 1.00 0.72 C ATOM 1850 CE2 PHE A 118 -16.258 0.069 -13.669 1.00 0.75 C ATOM 1851 CZ PHE A 118 -16.760 -0.980 -12.919 1.00 0.77 C ATOM 0 H PHE A 118 -11.382 2.328 -10.359 1.00 0.48 H new ATOM 0 HA PHE A 118 -12.128 -0.343 -11.206 1.00 0.51 H new ATOM 0 HB2 PHE A 118 -13.640 1.579 -10.343 1.00 0.56 H new ATOM 0 HB3 PHE A 118 -13.430 2.322 -11.916 1.00 0.56 H new ATOM 0 HD1 PHE A 118 -14.719 -0.760 -10.243 1.00 0.65 H new ATOM 0 HD2 PHE A 118 -14.816 1.639 -13.776 1.00 0.68 H new ATOM 0 HE1 PHE A 118 -16.593 -2.094 -11.102 1.00 0.72 H new ATOM 0 HE2 PHE A 118 -16.690 0.300 -14.631 1.00 0.75 H new ATOM 0 HZ PHE A 118 -17.585 -1.567 -13.294 1.00 0.77 H new ATOM 1861 N ASP A 119 -10.983 1.822 -13.478 1.00 0.52 N ATOM 1862 CA ASP A 119 -10.410 1.986 -14.851 1.00 0.54 C ATOM 1863 C ASP A 119 -9.063 1.195 -15.061 1.00 0.53 C ATOM 1864 O ASP A 119 -8.734 0.831 -16.192 1.00 0.57 O ATOM 1865 CB ASP A 119 -10.188 3.488 -15.139 1.00 0.55 C ATOM 1866 CG ASP A 119 -10.545 3.919 -16.566 1.00 0.57 C ATOM 1867 OD1 ASP A 119 -10.490 3.070 -17.480 1.00 0.72 O ATOM 1868 OD2 ASP A 119 -10.866 5.112 -16.761 1.00 0.91 O ATOM 0 H ASP A 119 -10.864 2.651 -12.896 1.00 0.52 H new ATOM 0 HA ASP A 119 -11.131 1.564 -15.551 1.00 0.54 H new ATOM 0 HB2 ASP A 119 -10.783 4.072 -14.437 1.00 0.55 H new ATOM 0 HB3 ASP A 119 -9.142 3.731 -14.950 1.00 0.55 H new ATOM 1873 N ARG A 120 -8.299 0.950 -13.951 1.00 0.49 N ATOM 1874 CA ARG A 120 -7.010 0.204 -13.988 1.00 0.48 C ATOM 1875 C ARG A 120 -7.189 -1.342 -14.033 1.00 0.50 C ATOM 1876 O ARG A 120 -6.699 -1.975 -14.972 1.00 0.54 O ATOM 1877 CB ARG A 120 -6.136 0.586 -12.778 1.00 0.46 C ATOM 1878 CG ARG A 120 -5.569 2.031 -12.801 1.00 0.45 C ATOM 1879 CD ARG A 120 -4.303 2.177 -13.666 1.00 0.52 C ATOM 1880 NE ARG A 120 -3.820 3.555 -13.687 1.00 1.23 N ATOM 1881 CZ ARG A 120 -2.724 3.944 -14.331 1.00 1.49 C ATOM 1882 NH1 ARG A 120 -1.997 3.062 -15.005 1.00 1.03 N ATOM 1883 NH2 ARG A 120 -2.353 5.218 -14.302 1.00 2.43 N ATOM 0 H ARG A 120 -8.561 1.263 -13.016 1.00 0.49 H new ATOM 0 HA ARG A 120 -6.519 0.494 -14.917 1.00 0.48 H new ATOM 0 HB2 ARG A 120 -6.725 0.459 -11.870 1.00 0.46 H new ATOM 0 HB3 ARG A 120 -5.302 -0.113 -12.717 1.00 0.46 H new ATOM 0 HG2 ARG A 120 -6.336 2.709 -13.176 1.00 0.45 H new ATOM 0 HG3 ARG A 120 -5.341 2.340 -11.781 1.00 0.45 H new ATOM 0 HD2 ARG A 120 -3.521 1.523 -13.280 1.00 0.52 H new ATOM 0 HD3 ARG A 120 -4.518 1.851 -14.684 1.00 0.52 H new ATOM 0 HE ARG A 120 -4.354 4.259 -13.178 1.00 1.23 H new ATOM 0 HH11 ARG A 120 -2.279 2.082 -15.030 1.00 1.03 H new ATOM 0 HH12 ARG A 120 -1.157 3.364 -15.498 1.00 1.03 H new ATOM 0 HH21 ARG A 120 -2.909 5.899 -13.785 1.00 2.43 H new ATOM 0 HH22 ARG A 120 -1.512 5.516 -14.796 1.00 2.43 H new ATOM 1897 N VAL A 121 -7.884 -1.954 -13.029 1.00 0.48 N ATOM 1898 CA VAL A 121 -8.126 -3.444 -13.047 1.00 0.51 C ATOM 1899 C VAL A 121 -9.458 -3.873 -13.770 1.00 0.56 C ATOM 1900 O VAL A 121 -9.478 -4.915 -14.431 1.00 0.62 O ATOM 1901 CB VAL A 121 -8.008 -4.200 -11.633 1.00 0.53 C ATOM 1902 CG1 VAL A 121 -6.545 -4.576 -11.324 1.00 0.92 C ATOM 1903 CG2 VAL A 121 -8.594 -3.440 -10.405 1.00 0.93 C ATOM 0 H VAL A 121 -8.276 -1.468 -12.223 1.00 0.48 H new ATOM 0 HA VAL A 121 -7.280 -3.782 -13.645 1.00 0.51 H new ATOM 0 HB VAL A 121 -8.628 -5.086 -11.768 1.00 0.53 H new ATOM 0 HG11 VAL A 121 -6.496 -5.086 -10.362 1.00 0.92 H new ATOM 0 HG12 VAL A 121 -6.166 -5.236 -12.104 1.00 0.92 H new ATOM 0 HG13 VAL A 121 -5.937 -3.672 -11.287 1.00 0.92 H new ATOM 0 HG21 VAL A 121 -8.460 -4.042 -9.506 1.00 0.93 H new ATOM 0 HG22 VAL A 121 -8.076 -2.489 -10.285 1.00 0.93 H new ATOM 0 HG23 VAL A 121 -9.657 -3.257 -10.564 1.00 0.93 H new ATOM 1913 N GLY A 122 -10.550 -3.072 -13.639 1.00 0.57 N ATOM 1914 CA GLY A 122 -11.832 -3.401 -14.293 1.00 0.63 C ATOM 1915 C GLY A 122 -12.930 -3.844 -13.322 1.00 0.66 C ATOM 1916 O GLY A 122 -13.876 -3.100 -13.055 1.00 0.85 O ATOM 0 H GLY A 122 -10.563 -2.210 -13.095 1.00 0.57 H new ATOM 0 HA2 GLY A 122 -12.180 -2.529 -14.846 1.00 0.63 H new ATOM 0 HA3 GLY A 122 -11.664 -4.194 -15.022 1.00 0.63 H new ATOM 1920 N HIS A 123 -12.776 -5.076 -12.803 1.00 0.72 N ATOM 1921 CA HIS A 123 -13.711 -5.699 -11.836 1.00 0.87 C ATOM 1922 C HIS A 123 -13.152 -5.661 -10.390 1.00 0.73 C ATOM 1923 O HIS A 123 -12.024 -5.198 -10.161 1.00 1.34 O ATOM 1924 CB HIS A 123 -14.001 -7.156 -12.248 1.00 1.38 C ATOM 1925 CG HIS A 123 -14.809 -7.291 -13.508 1.00 1.76 C ATOM 1926 ND1 HIS A 123 -14.293 -7.798 -14.683 1.00 2.62 N ATOM 1927 CD2 HIS A 123 -16.105 -6.988 -13.771 1.00 2.27 C ATOM 1928 CE1 HIS A 123 -15.233 -7.799 -15.611 1.00 3.18 C ATOM 1929 NE2 HIS A 123 -16.341 -7.313 -15.083 1.00 3.01 N ATOM 0 H HIS A 123 -11.989 -5.679 -13.044 1.00 0.72 H new ATOM 0 HA HIS A 123 -14.636 -5.123 -11.851 1.00 0.87 H new ATOM 0 HB2 HIS A 123 -13.054 -7.680 -12.379 1.00 1.38 H new ATOM 0 HB3 HIS A 123 -14.531 -7.653 -11.435 1.00 1.38 H new ATOM 0 HD2 HIS A 123 -16.818 -6.569 -13.077 1.00 2.27 H new ATOM 0 HE1 HIS A 123 -15.115 -8.140 -16.629 1.00 3.18 H new ATOM 0 HE2 HIS A 123 -17.229 -7.198 -15.571 1.00 3.01 H new ATOM 1938 N SER A 124 -13.968 -6.120 -9.397 1.00 0.86 N ATOM 1939 CA SER A 124 -13.578 -6.147 -7.948 1.00 0.70 C ATOM 1940 C SER A 124 -12.506 -7.231 -7.614 1.00 0.99 C ATOM 1941 O SER A 124 -12.818 -8.370 -7.248 1.00 2.08 O ATOM 1942 CB SER A 124 -14.823 -6.350 -7.071 1.00 0.73 C ATOM 1943 OG SER A 124 -15.545 -5.140 -6.907 1.00 1.20 O ATOM 0 H SER A 124 -14.906 -6.479 -9.572 1.00 0.86 H new ATOM 0 HA SER A 124 -13.120 -5.182 -7.732 1.00 0.70 H new ATOM 0 HB2 SER A 124 -15.469 -7.102 -7.523 1.00 0.73 H new ATOM 0 HB3 SER A 124 -14.524 -6.732 -6.095 1.00 0.73 H new ATOM 0 HG SER A 124 -16.332 -5.302 -6.346 1.00 1.20 H new ATOM 1949 N THR A 125 -11.240 -6.811 -7.770 1.00 0.56 N ATOM 1950 CA THR A 125 -10.031 -7.650 -7.557 1.00 0.51 C ATOM 1951 C THR A 125 -8.924 -6.819 -6.832 1.00 0.48 C ATOM 1952 O THR A 125 -9.212 -5.781 -6.217 1.00 0.51 O ATOM 1953 CB THR A 125 -9.465 -8.213 -8.937 1.00 0.55 C ATOM 1954 OG1 THR A 125 -9.751 -7.329 -10.039 1.00 0.62 O ATOM 1955 CG2 THR A 125 -10.008 -9.615 -9.275 1.00 0.62 C ATOM 0 H THR A 125 -11.015 -5.858 -8.054 1.00 0.56 H new ATOM 0 HA THR A 125 -10.317 -8.498 -6.935 1.00 0.51 H new ATOM 0 HB THR A 125 -8.386 -8.280 -8.796 1.00 0.55 H new ATOM 0 HG1 THR A 125 -9.387 -7.709 -10.866 1.00 0.62 H new ATOM 0 HG21 THR A 125 -9.589 -9.948 -10.225 1.00 0.62 H new ATOM 0 HG22 THR A 125 -9.725 -10.314 -8.488 1.00 0.62 H new ATOM 0 HG23 THR A 125 -11.095 -9.576 -9.351 1.00 0.62 H new ATOM 1963 N ALA A 126 -7.648 -7.288 -6.885 1.00 0.46 N ATOM 1964 CA ALA A 126 -6.509 -6.578 -6.253 1.00 0.43 C ATOM 1965 C ALA A 126 -5.677 -5.717 -7.260 1.00 0.38 C ATOM 1966 O ALA A 126 -5.294 -6.182 -8.348 1.00 0.41 O ATOM 1967 CB ALA A 126 -5.591 -7.598 -5.531 1.00 0.46 C ATOM 0 H ALA A 126 -7.386 -8.153 -7.358 1.00 0.46 H new ATOM 0 HA ALA A 126 -6.934 -5.879 -5.533 1.00 0.43 H new ATOM 0 HB1 ALA A 126 -4.756 -7.072 -5.068 1.00 0.46 H new ATOM 0 HB2 ALA A 126 -6.161 -8.120 -4.763 1.00 0.46 H new ATOM 0 HB3 ALA A 126 -5.210 -8.320 -6.254 1.00 0.46 H new ATOM 1973 N HIS A 127 -5.431 -4.431 -6.886 1.00 0.34 N ATOM 1974 CA HIS A 127 -4.603 -3.497 -7.693 1.00 0.32 C ATOM 1975 C HIS A 127 -3.204 -3.353 -7.042 1.00 0.31 C ATOM 1976 O HIS A 127 -3.086 -3.276 -5.815 1.00 0.35 O ATOM 1977 CB HIS A 127 -5.281 -2.112 -7.820 1.00 0.32 C ATOM 1978 CG HIS A 127 -4.583 -1.152 -8.762 1.00 0.33 C ATOM 1979 ND1 HIS A 127 -4.081 -1.528 -9.993 1.00 0.35 N ATOM 1980 CD2 HIS A 127 -4.266 0.159 -8.621 1.00 0.36 C ATOM 1981 CE1 HIS A 127 -3.485 -0.493 -10.559 1.00 0.38 C ATOM 1982 NE2 HIS A 127 -3.587 0.539 -9.748 1.00 0.38 N ATOM 0 H HIS A 127 -5.797 -4.019 -6.028 1.00 0.34 H new ATOM 0 HA HIS A 127 -4.497 -3.907 -8.697 1.00 0.32 H new ATOM 0 HB2 HIS A 127 -6.306 -2.254 -8.161 1.00 0.32 H new ATOM 0 HB3 HIS A 127 -5.334 -1.656 -6.831 1.00 0.32 H new ATOM 0 HD2 HIS A 127 -4.505 0.787 -7.776 1.00 0.36 H new ATOM 0 HE1 HIS A 127 -2.997 -0.494 -11.523 1.00 0.38 H new ATOM 0 HE2 HIS A 127 -3.219 1.473 -9.930 1.00 0.38 H new ATOM 1991 N ASP A 128 -2.157 -3.271 -7.870 1.00 0.32 N ATOM 1992 CA ASP A 128 -0.781 -3.202 -7.344 1.00 0.33 C ATOM 1993 C ASP A 128 0.101 -2.123 -8.007 1.00 0.30 C ATOM 1994 O ASP A 128 0.271 -2.088 -9.230 1.00 0.42 O ATOM 1995 CB ASP A 128 -0.065 -4.618 -7.377 1.00 0.45 C ATOM 1996 CG ASP A 128 -0.027 -5.360 -8.738 1.00 1.70 C ATOM 1997 OD1 ASP A 128 -1.014 -6.052 -9.067 1.00 2.10 O ATOM 1998 OD2 ASP A 128 0.990 -5.236 -9.453 1.00 2.50 O ATOM 0 H ASP A 128 -2.228 -3.251 -8.887 1.00 0.32 H new ATOM 0 HA ASP A 128 -0.896 -2.893 -6.305 1.00 0.33 H new ATOM 0 HB2 ASP A 128 0.962 -4.486 -7.035 1.00 0.45 H new ATOM 0 HB3 ASP A 128 -0.561 -5.265 -6.653 1.00 0.45 H new ATOM 2003 N GLU A 129 0.648 -1.242 -7.154 1.00 0.25 N ATOM 2004 CA GLU A 129 1.580 -0.195 -7.591 1.00 0.30 C ATOM 2005 C GLU A 129 3.006 -0.473 -7.054 1.00 0.27 C ATOM 2006 O GLU A 129 3.236 -0.536 -5.832 1.00 0.25 O ATOM 2007 CB GLU A 129 1.080 1.189 -7.142 1.00 0.43 C ATOM 2008 CG GLU A 129 -0.179 1.689 -7.885 1.00 0.91 C ATOM 2009 CD GLU A 129 0.068 1.985 -9.360 1.00 0.76 C ATOM 2010 OE1 GLU A 129 1.110 2.595 -9.679 1.00 1.12 O ATOM 2011 OE2 GLU A 129 -0.783 1.606 -10.193 1.00 1.56 O ATOM 0 H GLU A 129 0.458 -1.236 -6.152 1.00 0.25 H new ATOM 0 HA GLU A 129 1.625 -0.203 -8.680 1.00 0.30 H new ATOM 0 HB2 GLU A 129 0.866 1.155 -6.074 1.00 0.43 H new ATOM 0 HB3 GLU A 129 1.882 1.914 -7.283 1.00 0.43 H new ATOM 0 HG2 GLU A 129 -0.965 0.939 -7.799 1.00 0.91 H new ATOM 0 HG3 GLU A 129 -0.546 2.592 -7.397 1.00 0.91 H new ATOM 2018 N ILE A 130 3.946 -0.651 -8.010 1.00 0.28 N ATOM 2019 CA ILE A 130 5.374 -0.961 -7.728 1.00 0.28 C ATOM 2020 C ILE A 130 6.293 0.242 -8.066 1.00 0.29 C ATOM 2021 O ILE A 130 6.343 0.702 -9.215 1.00 0.39 O ATOM 2022 CB ILE A 130 5.899 -2.228 -8.534 1.00 0.31 C ATOM 2023 CG1 ILE A 130 4.761 -2.975 -9.298 1.00 0.37 C ATOM 2024 CG2 ILE A 130 6.654 -3.236 -7.618 1.00 0.37 C ATOM 2025 CD1 ILE A 130 4.646 -2.631 -10.782 1.00 0.45 C ATOM 0 H ILE A 130 3.738 -0.584 -9.006 1.00 0.28 H new ATOM 0 HA ILE A 130 5.417 -1.180 -6.661 1.00 0.28 H new ATOM 0 HB ILE A 130 6.597 -1.828 -9.270 1.00 0.31 H new ATOM 0 HG12 ILE A 130 4.923 -4.049 -9.201 1.00 0.37 H new ATOM 0 HG13 ILE A 130 3.811 -2.751 -8.814 1.00 0.37 H new ATOM 0 HG21 ILE A 130 6.993 -4.084 -8.213 1.00 0.37 H new ATOM 0 HG22 ILE A 130 7.514 -2.743 -7.165 1.00 0.37 H new ATOM 0 HG23 ILE A 130 5.984 -3.588 -6.834 1.00 0.37 H new ATOM 0 HD11 ILE A 130 3.828 -3.199 -11.225 1.00 0.45 H new ATOM 0 HD12 ILE A 130 4.449 -1.565 -10.894 1.00 0.45 H new ATOM 0 HD13 ILE A 130 5.578 -2.883 -11.287 1.00 0.45 H new ATOM 2037 N ILE A 131 7.024 0.727 -7.045 1.00 0.21 N ATOM 2038 CA ILE A 131 7.952 1.864 -7.210 1.00 0.26 C ATOM 2039 C ILE A 131 9.366 1.531 -6.609 1.00 0.18 C ATOM 2040 O ILE A 131 9.549 1.670 -5.391 1.00 0.18 O ATOM 2041 CB ILE A 131 7.404 3.200 -6.541 1.00 0.34 C ATOM 2042 CG1 ILE A 131 5.839 3.249 -6.535 1.00 0.30 C ATOM 2043 CG2 ILE A 131 7.975 4.459 -7.282 1.00 0.62 C ATOM 2044 CD1 ILE A 131 5.192 3.595 -5.195 1.00 0.84 C ATOM 0 H ILE A 131 6.991 0.350 -6.098 1.00 0.21 H new ATOM 0 HA ILE A 131 8.038 2.031 -8.284 1.00 0.26 H new ATOM 0 HB ILE A 131 7.743 3.206 -5.505 1.00 0.34 H new ATOM 0 HG12 ILE A 131 5.514 3.981 -7.274 1.00 0.30 H new ATOM 0 HG13 ILE A 131 5.462 2.279 -6.860 1.00 0.30 H new ATOM 0 HG21 ILE A 131 7.590 5.364 -6.812 1.00 0.62 H new ATOM 0 HG22 ILE A 131 9.063 4.454 -7.222 1.00 0.62 H new ATOM 0 HG23 ILE A 131 7.669 4.436 -8.328 1.00 0.62 H new ATOM 0 HD11 ILE A 131 4.108 3.601 -5.305 1.00 0.84 H new ATOM 0 HD12 ILE A 131 5.477 2.851 -4.451 1.00 0.84 H new ATOM 0 HD13 ILE A 131 5.529 4.580 -4.872 1.00 0.84 H new ATOM 2056 N PRO A 132 10.384 1.048 -7.431 1.00 0.13 N ATOM 2057 CA PRO A 132 11.788 0.821 -6.941 1.00 0.09 C ATOM 2058 C PRO A 132 12.581 2.139 -6.768 1.00 0.08 C ATOM 2059 O PRO A 132 12.592 2.995 -7.658 1.00 0.16 O ATOM 2060 CB PRO A 132 12.440 -0.036 -8.047 1.00 0.13 C ATOM 2061 CG PRO A 132 11.280 -0.575 -8.831 1.00 0.16 C ATOM 2062 CD PRO A 132 10.251 0.543 -8.820 1.00 0.16 C ATOM 0 HA PRO A 132 11.787 0.349 -5.959 1.00 0.09 H new ATOM 0 HB2 PRO A 132 13.101 0.561 -8.675 1.00 0.13 H new ATOM 0 HB3 PRO A 132 13.042 -0.840 -7.624 1.00 0.13 H new ATOM 0 HG2 PRO A 132 11.575 -0.831 -9.849 1.00 0.16 H new ATOM 0 HG3 PRO A 132 10.883 -1.483 -8.376 1.00 0.16 H new ATOM 0 HD2 PRO A 132 10.472 1.312 -9.560 1.00 0.16 H new ATOM 0 HD3 PRO A 132 9.246 0.178 -9.030 1.00 0.16 H new ATOM 2070 N ILE A 133 13.233 2.270 -5.605 1.00 0.07 N ATOM 2071 CA ILE A 133 13.989 3.476 -5.226 1.00 0.08 C ATOM 2072 C ILE A 133 15.516 3.166 -5.094 1.00 0.08 C ATOM 2073 O ILE A 133 15.922 2.069 -4.694 1.00 0.10 O ATOM 2074 CB ILE A 133 13.402 4.085 -3.865 1.00 0.15 C ATOM 2075 CG1 ILE A 133 11.832 3.954 -3.810 1.00 0.23 C ATOM 2076 CG2 ILE A 133 13.809 5.582 -3.658 1.00 0.30 C ATOM 2077 CD1 ILE A 133 11.222 3.614 -2.439 1.00 0.38 C ATOM 0 H ILE A 133 13.252 1.538 -4.894 1.00 0.07 H new ATOM 0 HA ILE A 133 13.876 4.219 -6.015 1.00 0.08 H new ATOM 0 HB ILE A 133 13.840 3.500 -3.056 1.00 0.15 H new ATOM 0 HG12 ILE A 133 11.398 4.893 -4.153 1.00 0.23 H new ATOM 0 HG13 ILE A 133 11.528 3.184 -4.520 1.00 0.23 H new ATOM 0 HG21 ILE A 133 13.387 5.948 -2.722 1.00 0.30 H new ATOM 0 HG22 ILE A 133 14.895 5.662 -3.622 1.00 0.30 H new ATOM 0 HG23 ILE A 133 13.429 6.180 -4.486 1.00 0.30 H new ATOM 0 HD11 ILE A 133 10.138 3.551 -2.529 1.00 0.38 H new ATOM 0 HD12 ILE A 133 11.614 2.657 -2.094 1.00 0.38 H new ATOM 0 HD13 ILE A 133 11.482 4.393 -1.722 1.00 0.38 H new ATOM 2089 N SER A 134 16.337 4.170 -5.443 1.00 0.10 N ATOM 2090 CA SER A 134 17.797 4.060 -5.350 1.00 0.12 C ATOM 2091 C SER A 134 18.408 5.257 -4.588 1.00 0.13 C ATOM 2092 O SER A 134 18.409 6.394 -5.074 1.00 0.15 O ATOM 2093 CB SER A 134 18.453 3.894 -6.756 1.00 0.15 C ATOM 2094 OG SER A 134 17.978 4.844 -7.714 1.00 1.31 O ATOM 0 H SER A 134 16.009 5.070 -5.793 1.00 0.10 H new ATOM 0 HA SER A 134 18.015 3.158 -4.778 1.00 0.12 H new ATOM 0 HB2 SER A 134 19.534 3.994 -6.660 1.00 0.15 H new ATOM 0 HB3 SER A 134 18.258 2.887 -7.125 1.00 0.15 H new ATOM 0 HG SER A 134 18.424 4.693 -8.573 1.00 1.31 H new ATOM 2100 N ILE A 135 18.909 4.966 -3.370 1.00 0.13 N ATOM 2101 CA ILE A 135 19.563 5.969 -2.499 1.00 0.15 C ATOM 2102 C ILE A 135 21.082 5.612 -2.392 1.00 0.18 C ATOM 2103 O ILE A 135 21.446 4.496 -1.998 1.00 0.18 O ATOM 2104 CB ILE A 135 18.848 6.065 -1.061 1.00 0.16 C ATOM 2105 CG1 ILE A 135 17.313 6.261 -1.206 1.00 0.13 C ATOM 2106 CG2 ILE A 135 19.418 7.207 -0.140 1.00 0.25 C ATOM 2107 CD1 ILE A 135 16.452 5.339 -0.328 1.00 0.15 C ATOM 0 H ILE A 135 18.873 4.032 -2.962 1.00 0.13 H new ATOM 0 HA ILE A 135 19.463 6.962 -2.938 1.00 0.15 H new ATOM 0 HB ILE A 135 19.066 5.113 -0.578 1.00 0.16 H new ATOM 0 HG12 ILE A 135 17.070 7.296 -0.966 1.00 0.13 H new ATOM 0 HG13 ILE A 135 17.039 6.103 -2.249 1.00 0.13 H new ATOM 0 HG21 ILE A 135 18.885 7.207 0.811 1.00 0.25 H new ATOM 0 HG22 ILE A 135 20.479 7.035 0.039 1.00 0.25 H new ATOM 0 HG23 ILE A 135 19.285 8.171 -0.631 1.00 0.25 H new ATOM 0 HD11 ILE A 135 15.397 5.553 -0.501 1.00 0.15 H new ATOM 0 HD12 ILE A 135 16.658 4.299 -0.581 1.00 0.15 H new ATOM 0 HD13 ILE A 135 16.689 5.511 0.722 1.00 0.15 H new ATOM 2119 N LYS A 136 21.934 6.590 -2.767 1.00 0.20 N ATOM 2120 CA LYS A 136 23.402 6.435 -2.737 1.00 0.23 C ATOM 2121 C LYS A 136 24.072 7.707 -2.212 1.00 0.28 C ATOM 2122 O LYS A 136 23.821 8.816 -2.711 1.00 0.29 O ATOM 2123 CB LYS A 136 23.939 6.099 -4.143 1.00 0.22 C ATOM 2124 CG LYS A 136 23.565 4.681 -4.640 1.00 0.25 C ATOM 2125 CD LYS A 136 24.558 3.590 -4.170 1.00 0.94 C ATOM 2126 CE LYS A 136 24.141 2.187 -4.643 1.00 1.23 C ATOM 2127 NZ LYS A 136 24.065 2.105 -6.128 1.00 2.05 N ATOM 0 H LYS A 136 21.625 7.504 -3.097 1.00 0.20 H new ATOM 0 HA LYS A 136 23.640 5.613 -2.063 1.00 0.23 H new ATOM 0 HB2 LYS A 136 23.556 6.833 -4.852 1.00 0.22 H new ATOM 0 HB3 LYS A 136 25.025 6.196 -4.138 1.00 0.22 H new ATOM 0 HG2 LYS A 136 22.565 4.430 -4.286 1.00 0.25 H new ATOM 0 HG3 LYS A 136 23.526 4.683 -5.729 1.00 0.25 H new ATOM 0 HD2 LYS A 136 25.554 3.819 -4.549 1.00 0.94 H new ATOM 0 HD3 LYS A 136 24.621 3.602 -3.082 1.00 0.94 H new ATOM 0 HE2 LYS A 136 24.856 1.451 -4.274 1.00 1.23 H new ATOM 0 HE3 LYS A 136 23.172 1.932 -4.215 1.00 1.23 H new ATOM 0 HZ1 LYS A 136 23.932 1.114 -6.415 1.00 2.05 H new ATOM 0 HZ2 LYS A 136 23.263 2.674 -6.467 1.00 2.05 H new ATOM 0 HZ3 LYS A 136 24.947 2.469 -6.541 1.00 2.05 H new ATOM 2141 N LYS A 137 24.898 7.535 -1.136 1.00 0.33 N ATOM 2142 CA LYS A 137 25.660 8.638 -0.431 1.00 0.40 C ATOM 2143 C LYS A 137 24.747 9.664 0.333 1.00 0.39 C ATOM 2144 O LYS A 137 25.188 10.765 0.679 1.00 0.42 O ATOM 2145 CB LYS A 137 26.587 9.389 -1.432 1.00 0.44 C ATOM 2146 CG LYS A 137 27.911 9.966 -0.832 1.00 0.99 C ATOM 2147 CD LYS A 137 29.156 9.065 -1.072 1.00 1.59 C ATOM 2148 CE LYS A 137 29.072 7.695 -0.378 1.00 2.70 C ATOM 2149 NZ LYS A 137 30.357 6.950 -0.487 1.00 3.55 N ATOM 0 H LYS A 137 25.062 6.618 -0.721 1.00 0.33 H new ATOM 0 HA LYS A 137 26.259 8.139 0.331 1.00 0.40 H new ATOM 0 HB2 LYS A 137 26.845 8.706 -2.242 1.00 0.44 H new ATOM 0 HB3 LYS A 137 26.023 10.210 -1.875 1.00 0.44 H new ATOM 0 HG2 LYS A 137 28.097 10.949 -1.265 1.00 0.99 H new ATOM 0 HG3 LYS A 137 27.780 10.110 0.240 1.00 0.99 H new ATOM 0 HD2 LYS A 137 29.281 8.912 -2.144 1.00 1.59 H new ATOM 0 HD3 LYS A 137 30.045 9.587 -0.718 1.00 1.59 H new ATOM 0 HE2 LYS A 137 28.818 7.833 0.673 1.00 2.70 H new ATOM 0 HE3 LYS A 137 28.270 7.108 -0.825 1.00 2.70 H new ATOM 0 HZ1 LYS A 137 30.267 6.031 -0.009 1.00 3.55 H new ATOM 0 HZ2 LYS A 137 30.586 6.798 -1.490 1.00 3.55 H new ATOM 0 HZ3 LYS A 137 31.117 7.501 -0.038 1.00 3.55 H new ATOM 2163 N GLY A 138 23.479 9.261 0.594 1.00 0.35 N ATOM 2164 CA GLY A 138 22.490 10.115 1.263 1.00 0.36 C ATOM 2165 C GLY A 138 21.515 10.852 0.316 1.00 0.33 C ATOM 2166 O GLY A 138 20.829 11.776 0.760 1.00 0.37 O ATOM 0 H GLY A 138 23.123 8.338 0.345 1.00 0.35 H new ATOM 0 HA2 GLY A 138 21.909 9.501 1.952 1.00 0.36 H new ATOM 0 HA3 GLY A 138 23.019 10.855 1.864 1.00 0.36 H new ATOM 2170 N LYS A 139 21.446 10.453 -0.988 1.00 0.29 N ATOM 2171 CA LYS A 139 20.534 11.109 -1.948 1.00 0.29 C ATOM 2172 C LYS A 139 19.547 10.118 -2.599 1.00 0.26 C ATOM 2173 O LYS A 139 19.897 8.976 -2.901 1.00 0.25 O ATOM 2174 CB LYS A 139 21.313 11.860 -3.035 1.00 0.33 C ATOM 2175 CG LYS A 139 22.271 12.951 -2.503 1.00 0.65 C ATOM 2176 CD LYS A 139 23.210 13.533 -3.592 1.00 0.67 C ATOM 2177 CE LYS A 139 22.467 14.287 -4.709 1.00 1.00 C ATOM 2178 NZ LYS A 139 23.409 15.061 -5.564 1.00 1.56 N ATOM 0 H LYS A 139 22.003 9.695 -1.383 1.00 0.29 H new ATOM 0 HA LYS A 139 19.951 11.826 -1.370 1.00 0.29 H new ATOM 0 HB2 LYS A 139 21.890 11.139 -3.614 1.00 0.33 H new ATOM 0 HB3 LYS A 139 20.602 12.322 -3.720 1.00 0.33 H new ATOM 0 HG2 LYS A 139 21.683 13.761 -2.071 1.00 0.65 H new ATOM 0 HG3 LYS A 139 22.876 12.532 -1.699 1.00 0.65 H new ATOM 0 HD2 LYS A 139 23.923 14.210 -3.121 1.00 0.67 H new ATOM 0 HD3 LYS A 139 23.786 12.721 -4.035 1.00 0.67 H new ATOM 0 HE2 LYS A 139 21.915 13.576 -5.324 1.00 1.00 H new ATOM 0 HE3 LYS A 139 21.734 14.963 -4.268 1.00 1.00 H new ATOM 0 HZ1 LYS A 139 22.876 15.557 -6.307 1.00 1.56 H new ATOM 0 HZ2 LYS A 139 23.917 15.755 -4.980 1.00 1.56 H new ATOM 0 HZ3 LYS A 139 24.092 14.412 -6.003 1.00 1.56 H new ATOM 2192 N LEU A 140 18.329 10.612 -2.898 1.00 0.25 N ATOM 2193 CA LEU A 140 17.233 9.784 -3.443 1.00 0.24 C ATOM 2194 C LEU A 140 17.004 9.959 -4.964 1.00 0.26 C ATOM 2195 O LEU A 140 17.130 11.053 -5.517 1.00 0.34 O ATOM 2196 CB LEU A 140 15.941 10.156 -2.678 1.00 0.24 C ATOM 2197 CG LEU A 140 14.848 9.060 -2.499 1.00 0.22 C ATOM 2198 CD1 LEU A 140 14.332 9.010 -1.062 1.00 0.22 C ATOM 2199 CD2 LEU A 140 13.672 9.290 -3.434 1.00 0.25 C ATOM 0 H LEU A 140 18.077 11.592 -2.769 1.00 0.25 H new ATOM 0 HA LEU A 140 17.509 8.738 -3.307 1.00 0.24 H new ATOM 0 HB2 LEU A 140 16.230 10.503 -1.686 1.00 0.24 H new ATOM 0 HB3 LEU A 140 15.483 11.002 -3.190 1.00 0.24 H new ATOM 0 HG LEU A 140 15.322 8.109 -2.743 1.00 0.22 H new ATOM 0 HD11 LEU A 140 13.571 8.234 -0.975 1.00 0.22 H new ATOM 0 HD12 LEU A 140 15.158 8.786 -0.387 1.00 0.22 H new ATOM 0 HD13 LEU A 140 13.898 9.974 -0.797 1.00 0.22 H new ATOM 0 HD21 LEU A 140 12.928 8.507 -3.283 1.00 0.25 H new ATOM 0 HD22 LEU A 140 13.224 10.261 -3.224 1.00 0.25 H new ATOM 0 HD23 LEU A 140 14.019 9.266 -4.467 1.00 0.25 H new ATOM 2211 N SER A 141 16.650 8.840 -5.615 1.00 0.21 N ATOM 2212 CA SER A 141 16.358 8.816 -7.055 1.00 0.22 C ATOM 2213 C SER A 141 15.097 7.972 -7.341 1.00 0.19 C ATOM 2214 O SER A 141 15.091 6.750 -7.120 1.00 0.16 O ATOM 2215 CB SER A 141 17.560 8.245 -7.827 1.00 0.25 C ATOM 2216 OG SER A 141 17.727 8.887 -9.083 1.00 0.64 O ATOM 0 H SER A 141 16.559 7.932 -5.160 1.00 0.21 H new ATOM 0 HA SER A 141 16.173 9.838 -7.387 1.00 0.22 H new ATOM 0 HB2 SER A 141 18.466 8.366 -7.233 1.00 0.25 H new ATOM 0 HB3 SER A 141 17.420 7.175 -7.980 1.00 0.25 H new ATOM 0 HG SER A 141 18.500 8.502 -9.547 1.00 0.64 H new ATOM 2222 N VAL A 142 14.029 8.639 -7.834 1.00 0.21 N ATOM 2223 CA VAL A 142 12.765 7.957 -8.165 1.00 0.22 C ATOM 2224 C VAL A 142 12.465 8.074 -9.714 1.00 0.25 C ATOM 2225 O VAL A 142 12.130 9.151 -10.221 1.00 0.26 O ATOM 2226 CB VAL A 142 11.571 8.399 -7.130 1.00 0.27 C ATOM 2227 CG1 VAL A 142 10.496 9.414 -7.620 1.00 0.46 C ATOM 2228 CG2 VAL A 142 10.844 7.159 -6.592 1.00 0.41 C ATOM 0 H VAL A 142 14.020 9.644 -8.009 1.00 0.21 H new ATOM 0 HA VAL A 142 12.845 6.882 -8.000 1.00 0.22 H new ATOM 0 HB VAL A 142 12.129 8.944 -6.369 1.00 0.27 H new ATOM 0 HG11 VAL A 142 9.780 9.601 -6.819 1.00 0.46 H new ATOM 0 HG12 VAL A 142 10.980 10.350 -7.900 1.00 0.46 H new ATOM 0 HG13 VAL A 142 9.974 9.003 -8.484 1.00 0.46 H new ATOM 0 HG21 VAL A 142 10.055 7.469 -5.907 1.00 0.41 H new ATOM 0 HG22 VAL A 142 10.407 6.605 -7.422 1.00 0.41 H new ATOM 0 HG23 VAL A 142 11.553 6.522 -6.064 1.00 0.41 H new ATOM 2238 N GLN A 143 12.676 6.937 -10.450 1.00 0.31 N ATOM 2239 CA GLN A 143 12.448 6.794 -11.939 1.00 0.39 C ATOM 2240 C GLN A 143 13.414 7.655 -12.815 1.00 0.41 C ATOM 2241 O GLN A 143 14.443 7.162 -13.285 1.00 0.46 O ATOM 2242 CB GLN A 143 10.960 7.069 -12.320 1.00 0.44 C ATOM 2243 CG GLN A 143 9.928 6.246 -11.536 1.00 0.65 C ATOM 2244 CD GLN A 143 9.993 4.754 -11.826 1.00 0.87 C ATOM 2245 OE1 GLN A 143 9.332 4.255 -12.737 1.00 1.56 O ATOM 2246 NE2 GLN A 143 10.792 4.039 -11.043 1.00 1.12 N ATOM 0 H GLN A 143 13.015 6.075 -10.023 1.00 0.31 H new ATOM 0 HA GLN A 143 12.682 5.754 -12.166 1.00 0.39 H new ATOM 0 HB2 GLN A 143 10.751 8.128 -12.167 1.00 0.44 H new ATOM 0 HB3 GLN A 143 10.830 6.869 -13.384 1.00 0.44 H new ATOM 0 HG2 GLN A 143 10.081 6.407 -10.469 1.00 0.65 H new ATOM 0 HG3 GLN A 143 8.929 6.611 -11.773 1.00 0.65 H new ATOM 0 HE21 GLN A 143 11.321 4.496 -10.300 1.00 1.12 H new ATOM 0 HE22 GLN A 143 10.877 3.032 -11.184 1.00 1.12 H new ATOM 2255 N GLY A 144 13.047 8.937 -13.014 1.00 0.40 N ATOM 2256 CA GLY A 144 13.863 9.887 -13.773 1.00 0.45 C ATOM 2257 C GLY A 144 13.950 11.273 -13.101 1.00 0.42 C ATOM 2258 O GLY A 144 14.056 12.290 -13.791 1.00 0.49 O ATOM 0 H GLY A 144 12.180 9.335 -12.652 1.00 0.40 H new ATOM 0 HA2 GLY A 144 14.868 9.482 -13.891 1.00 0.45 H new ATOM 0 HA3 GLY A 144 13.445 9.999 -14.773 1.00 0.45 H new ATOM 2262 N GLU A 145 13.905 11.296 -11.746 1.00 0.33 N ATOM 2263 CA GLU A 145 13.979 12.532 -10.949 1.00 0.32 C ATOM 2264 C GLU A 145 14.950 12.348 -9.771 1.00 0.27 C ATOM 2265 O GLU A 145 14.808 11.417 -8.971 1.00 0.36 O ATOM 2266 CB GLU A 145 12.573 12.903 -10.421 1.00 0.37 C ATOM 2267 CG GLU A 145 12.238 14.402 -10.468 1.00 0.80 C ATOM 2268 CD GLU A 145 10.863 14.705 -9.904 1.00 1.16 C ATOM 2269 OE1 GLU A 145 9.864 14.501 -10.627 1.00 1.53 O ATOM 2270 OE2 GLU A 145 10.784 15.146 -8.739 1.00 1.82 O ATOM 0 H GLU A 145 13.816 10.452 -11.180 1.00 0.33 H new ATOM 0 HA GLU A 145 14.346 13.338 -11.584 1.00 0.32 H new ATOM 0 HB2 GLU A 145 11.828 12.361 -11.003 1.00 0.37 H new ATOM 0 HB3 GLU A 145 12.485 12.558 -9.391 1.00 0.37 H new ATOM 0 HG2 GLU A 145 12.989 14.957 -9.906 1.00 0.80 H new ATOM 0 HG3 GLU A 145 12.290 14.751 -11.499 1.00 0.80 H new ATOM 2277 N VAL A 146 15.926 13.264 -9.655 1.00 0.30 N ATOM 2278 CA VAL A 146 16.948 13.189 -8.589 1.00 0.27 C ATOM 2279 C VAL A 146 16.808 14.369 -7.541 1.00 0.28 C ATOM 2280 O VAL A 146 16.655 15.543 -7.901 1.00 0.32 O ATOM 2281 CB VAL A 146 18.425 12.981 -9.241 1.00 0.31 C ATOM 2282 CG1 VAL A 146 19.094 14.243 -9.876 1.00 1.02 C ATOM 2283 CG2 VAL A 146 19.420 12.298 -8.266 1.00 0.72 C ATOM 0 H VAL A 146 16.032 14.062 -10.281 1.00 0.30 H new ATOM 0 HA VAL A 146 16.778 12.302 -7.978 1.00 0.27 H new ATOM 0 HB VAL A 146 18.208 12.316 -10.077 1.00 0.31 H new ATOM 0 HG11 VAL A 146 20.072 13.974 -10.275 1.00 1.02 H new ATOM 0 HG12 VAL A 146 18.465 14.622 -10.682 1.00 1.02 H new ATOM 0 HG13 VAL A 146 19.212 15.014 -9.115 1.00 1.02 H new ATOM 0 HG21 VAL A 146 20.388 12.185 -8.754 1.00 0.72 H new ATOM 0 HG22 VAL A 146 19.534 12.912 -7.373 1.00 0.72 H new ATOM 0 HG23 VAL A 146 19.038 11.316 -7.985 1.00 0.72 H new ATOM 2293 N SER A 147 16.860 13.989 -6.253 1.00 0.27 N ATOM 2294 CA SER A 147 16.767 14.918 -5.117 1.00 0.29 C ATOM 2295 C SER A 147 17.571 14.354 -3.929 1.00 0.29 C ATOM 2296 O SER A 147 18.195 13.293 -4.032 1.00 0.30 O ATOM 2297 CB SER A 147 15.299 15.134 -4.704 1.00 0.31 C ATOM 2298 OG SER A 147 14.686 16.159 -5.472 1.00 0.56 O ATOM 0 H SER A 147 16.969 13.015 -5.969 1.00 0.27 H new ATOM 0 HA SER A 147 17.181 15.881 -5.416 1.00 0.29 H new ATOM 0 HB2 SER A 147 14.745 14.204 -4.829 1.00 0.31 H new ATOM 0 HB3 SER A 147 15.252 15.393 -3.646 1.00 0.31 H new ATOM 0 HG SER A 147 15.119 16.214 -6.349 1.00 0.56 H new ATOM 2304 N THR A 148 17.606 15.078 -2.803 1.00 0.30 N ATOM 2305 CA THR A 148 18.340 14.590 -1.616 1.00 0.31 C ATOM 2306 C THR A 148 17.399 14.028 -0.483 1.00 0.27 C ATOM 2307 O THR A 148 16.341 14.597 -0.185 1.00 0.32 O ATOM 2308 CB THR A 148 19.460 15.624 -1.109 1.00 0.44 C ATOM 2309 OG1 THR A 148 20.274 15.038 -0.076 1.00 1.25 O ATOM 2310 CG2 THR A 148 18.942 16.995 -0.601 1.00 0.99 C ATOM 0 H THR A 148 17.149 15.982 -2.683 1.00 0.30 H new ATOM 0 HA THR A 148 18.901 13.715 -1.944 1.00 0.31 H new ATOM 0 HB THR A 148 20.036 15.830 -2.011 1.00 0.44 H new ATOM 0 HG1 THR A 148 20.949 15.686 0.215 1.00 1.25 H new ATOM 0 HG21 THR A 148 19.786 17.609 -0.285 1.00 0.99 H new ATOM 0 HG22 THR A 148 18.405 17.501 -1.403 1.00 0.99 H new ATOM 0 HG23 THR A 148 18.270 16.840 0.243 1.00 0.99 H new ATOM 2318 N PHE A 149 17.836 12.897 0.130 1.00 0.26 N ATOM 2319 CA PHE A 149 17.113 12.218 1.251 1.00 0.24 C ATOM 2320 C PHE A 149 17.436 12.880 2.614 1.00 0.24 C ATOM 2321 O PHE A 149 18.604 12.945 3.020 1.00 0.29 O ATOM 2322 CB PHE A 149 17.499 10.702 1.303 1.00 0.23 C ATOM 2323 CG PHE A 149 16.926 9.926 2.506 1.00 0.22 C ATOM 2324 CD1 PHE A 149 15.565 9.606 2.584 1.00 0.22 C ATOM 2325 CD2 PHE A 149 17.760 9.474 3.533 1.00 0.24 C ATOM 2326 CE1 PHE A 149 15.068 8.864 3.638 1.00 0.24 C ATOM 2327 CE2 PHE A 149 17.259 8.740 4.588 1.00 0.26 C ATOM 2328 CZ PHE A 149 15.861 8.611 4.730 1.00 0.25 C ATOM 0 H PHE A 149 18.700 12.425 -0.136 1.00 0.26 H new ATOM 0 HA PHE A 149 16.044 12.318 1.064 1.00 0.24 H new ATOM 0 HB2 PHE A 149 17.158 10.224 0.385 1.00 0.23 H new ATOM 0 HB3 PHE A 149 18.586 10.619 1.320 1.00 0.23 H new ATOM 0 HD1 PHE A 149 14.894 9.944 1.809 1.00 0.22 H new ATOM 0 HD2 PHE A 149 18.815 9.703 3.500 1.00 0.24 H new ATOM 0 HE1 PHE A 149 14.058 8.484 3.603 1.00 0.24 H new ATOM 0 HE2 PHE A 149 17.927 8.271 5.295 1.00 0.26 H new ATOM 0 HZ PHE A 149 15.425 8.320 5.675 1.00 0.25 H new ATOM 2338 N THR A 150 16.391 13.352 3.314 1.00 0.25 N ATOM 2339 CA THR A 150 16.595 13.997 4.632 1.00 0.30 C ATOM 2340 C THR A 150 15.708 13.383 5.735 1.00 0.40 C ATOM 2341 O THR A 150 14.572 13.816 5.955 1.00 1.15 O ATOM 2342 CB THR A 150 16.378 15.564 4.612 1.00 0.66 C ATOM 2343 OG1 THR A 150 15.379 15.955 3.649 1.00 1.42 O ATOM 2344 CG2 THR A 150 17.685 16.339 4.326 1.00 1.18 C ATOM 0 H THR A 150 15.420 13.304 3.005 1.00 0.25 H new ATOM 0 HA THR A 150 17.642 13.803 4.863 1.00 0.30 H new ATOM 0 HB THR A 150 16.033 15.824 5.613 1.00 0.66 H new ATOM 0 HG1 THR A 150 15.271 16.929 3.667 1.00 1.42 H new ATOM 0 HG21 THR A 150 17.480 17.410 4.323 1.00 1.18 H new ATOM 0 HG22 THR A 150 18.419 16.112 5.099 1.00 1.18 H new ATOM 0 HG23 THR A 150 18.078 16.043 3.354 1.00 1.18 H new ATOM 2352 N GLY A 151 16.270 12.358 6.427 1.00 0.32 N ATOM 2353 CA GLY A 151 15.610 11.677 7.565 1.00 0.18 C ATOM 2354 C GLY A 151 14.509 10.642 7.270 1.00 0.20 C ATOM 2355 O GLY A 151 14.684 9.462 7.579 1.00 0.42 O ATOM 0 H GLY A 151 17.193 11.983 6.209 1.00 0.32 H new ATOM 0 HA2 GLY A 151 16.385 11.178 8.146 1.00 0.18 H new ATOM 0 HA3 GLY A 151 15.178 12.446 8.205 1.00 0.18 H new ATOM 2359 N LYS A 152 13.379 11.084 6.689 1.00 0.16 N ATOM 2360 CA LYS A 152 12.236 10.191 6.434 1.00 0.13 C ATOM 2361 C LYS A 152 11.650 10.299 5.001 1.00 0.13 C ATOM 2362 O LYS A 152 11.800 11.304 4.300 1.00 0.16 O ATOM 2363 CB LYS A 152 11.158 10.476 7.556 1.00 0.22 C ATOM 2364 CG LYS A 152 9.656 10.236 7.208 1.00 0.41 C ATOM 2365 CD LYS A 152 8.825 11.546 7.073 1.00 0.56 C ATOM 2366 CE LYS A 152 9.307 12.477 5.942 1.00 0.69 C ATOM 2367 NZ LYS A 152 10.473 13.308 6.351 1.00 1.10 N ATOM 0 H LYS A 152 13.234 12.048 6.389 1.00 0.16 H new ATOM 0 HA LYS A 152 12.578 9.157 6.483 1.00 0.13 H new ATOM 0 HB2 LYS A 152 11.403 9.858 8.419 1.00 0.22 H new ATOM 0 HB3 LYS A 152 11.267 11.515 7.867 1.00 0.22 H new ATOM 0 HG2 LYS A 152 9.594 9.679 6.273 1.00 0.41 H new ATOM 0 HG3 LYS A 152 9.209 9.611 7.981 1.00 0.41 H new ATOM 0 HD2 LYS A 152 7.781 11.286 6.897 1.00 0.56 H new ATOM 0 HD3 LYS A 152 8.863 12.088 8.018 1.00 0.56 H new ATOM 0 HE2 LYS A 152 9.578 11.878 5.072 1.00 0.69 H new ATOM 0 HE3 LYS A 152 8.488 13.129 5.638 1.00 0.69 H new ATOM 0 HZ1 LYS A 152 10.472 14.197 5.811 1.00 1.10 H new ATOM 0 HZ2 LYS A 152 10.409 13.520 7.367 1.00 1.10 H new ATOM 0 HZ3 LYS A 152 11.353 12.788 6.161 1.00 1.10 H new ATOM 2381 N LEU A 153 10.961 9.201 4.624 1.00 0.12 N ATOM 2382 CA LEU A 153 10.232 9.047 3.332 1.00 0.13 C ATOM 2383 C LEU A 153 8.717 9.183 3.589 1.00 0.13 C ATOM 2384 O LEU A 153 8.214 8.650 4.587 1.00 0.18 O ATOM 2385 CB LEU A 153 10.535 7.660 2.721 1.00 0.15 C ATOM 2386 CG LEU A 153 10.972 7.592 1.225 1.00 0.34 C ATOM 2387 CD1 LEU A 153 11.854 6.375 0.959 1.00 0.43 C ATOM 2388 CD2 LEU A 153 9.774 7.537 0.283 1.00 0.67 C ATOM 0 H LEU A 153 10.890 8.375 5.218 1.00 0.12 H new ATOM 0 HA LEU A 153 10.557 9.819 2.635 1.00 0.13 H new ATOM 0 HB2 LEU A 153 11.321 7.198 3.319 1.00 0.15 H new ATOM 0 HB3 LEU A 153 9.643 7.044 2.835 1.00 0.15 H new ATOM 0 HG LEU A 153 11.536 8.505 1.032 1.00 0.34 H new ATOM 0 HD11 LEU A 153 12.141 6.357 -0.092 1.00 0.43 H new ATOM 0 HD12 LEU A 153 12.749 6.432 1.579 1.00 0.43 H new ATOM 0 HD13 LEU A 153 11.303 5.466 1.200 1.00 0.43 H new ATOM 0 HD21 LEU A 153 10.124 7.491 -0.748 1.00 0.67 H new ATOM 0 HD22 LEU A 153 9.178 6.652 0.504 1.00 0.67 H new ATOM 0 HD23 LEU A 153 9.163 8.429 0.419 1.00 0.67 H new ATOM 2400 N SER A 154 7.969 9.880 2.709 1.00 0.14 N ATOM 2401 CA SER A 154 6.534 10.065 2.981 1.00 0.16 C ATOM 2402 C SER A 154 5.579 9.520 1.895 1.00 0.19 C ATOM 2403 O SER A 154 5.832 9.611 0.704 1.00 0.36 O ATOM 2404 CB SER A 154 6.275 11.570 3.188 1.00 0.21 C ATOM 2405 OG SER A 154 5.114 11.824 3.973 1.00 0.24 O ATOM 0 H SER A 154 8.314 10.304 1.847 1.00 0.14 H new ATOM 0 HA SER A 154 6.311 9.476 3.871 1.00 0.16 H new ATOM 0 HB2 SER A 154 7.142 12.021 3.672 1.00 0.21 H new ATOM 0 HB3 SER A 154 6.165 12.053 2.217 1.00 0.21 H new ATOM 0 HG SER A 154 4.884 11.021 4.486 1.00 0.24 H new ATOM 2411 N VAL A 155 4.446 8.957 2.353 1.00 0.16 N ATOM 2412 CA VAL A 155 3.381 8.456 1.432 1.00 0.19 C ATOM 2413 C VAL A 155 2.132 9.337 1.646 1.00 0.25 C ATOM 2414 O VAL A 155 1.348 9.107 2.568 1.00 0.30 O ATOM 2415 CB VAL A 155 2.945 6.914 1.551 1.00 0.28 C ATOM 2416 CG1 VAL A 155 3.135 6.173 0.211 1.00 0.39 C ATOM 2417 CG2 VAL A 155 3.657 6.096 2.655 1.00 0.74 C ATOM 0 H VAL A 155 4.235 8.833 3.343 1.00 0.16 H new ATOM 0 HA VAL A 155 3.822 8.520 0.437 1.00 0.19 H new ATOM 0 HB VAL A 155 1.894 6.975 1.833 1.00 0.28 H new ATOM 0 HG11 VAL A 155 2.831 5.132 0.324 1.00 0.39 H new ATOM 0 HG12 VAL A 155 2.524 6.648 -0.557 1.00 0.39 H new ATOM 0 HG13 VAL A 155 4.184 6.215 -0.082 1.00 0.39 H new ATOM 0 HG21 VAL A 155 3.286 5.071 2.645 1.00 0.74 H new ATOM 0 HG22 VAL A 155 4.731 6.095 2.471 1.00 0.74 H new ATOM 0 HG23 VAL A 155 3.456 6.545 3.628 1.00 0.74 H new ATOM 2427 N GLU A 156 1.973 10.337 0.768 1.00 0.28 N ATOM 2428 CA GLU A 156 0.868 11.302 0.863 1.00 0.36 C ATOM 2429 C GLU A 156 -0.140 11.185 -0.281 1.00 0.34 C ATOM 2430 O GLU A 156 0.228 11.199 -1.460 1.00 0.38 O ATOM 2431 CB GLU A 156 1.438 12.734 0.880 1.00 0.53 C ATOM 2432 CG GLU A 156 2.018 13.179 2.224 1.00 0.73 C ATOM 2433 CD GLU A 156 2.695 14.535 2.145 1.00 1.26 C ATOM 2434 OE1 GLU A 156 3.908 14.578 1.847 1.00 1.66 O ATOM 2435 OE2 GLU A 156 2.011 15.555 2.378 1.00 1.67 O ATOM 0 H GLU A 156 2.599 10.499 -0.020 1.00 0.28 H new ATOM 0 HA GLU A 156 0.335 11.076 1.787 1.00 0.36 H new ATOM 0 HB2 GLU A 156 2.217 12.809 0.122 1.00 0.53 H new ATOM 0 HB3 GLU A 156 0.647 13.428 0.594 1.00 0.53 H new ATOM 0 HG2 GLU A 156 1.220 13.218 2.965 1.00 0.73 H new ATOM 0 HG3 GLU A 156 2.738 12.437 2.569 1.00 0.73 H new ATOM 2442 N PHE A 157 -1.430 11.070 0.086 1.00 0.35 N ATOM 2443 CA PHE A 157 -2.510 10.996 -0.912 1.00 0.40 C ATOM 2444 C PHE A 157 -3.407 12.242 -0.817 1.00 0.41 C ATOM 2445 O PHE A 157 -3.937 12.575 0.262 1.00 0.43 O ATOM 2446 CB PHE A 157 -3.391 9.725 -0.791 1.00 0.51 C ATOM 2447 CG PHE A 157 -2.700 8.450 -0.296 1.00 0.60 C ATOM 2448 CD1 PHE A 157 -1.508 8.001 -0.876 1.00 0.99 C ATOM 2449 CD2 PHE A 157 -3.224 7.724 0.769 1.00 1.03 C ATOM 2450 CE1 PHE A 157 -0.873 6.864 -0.407 1.00 1.55 C ATOM 2451 CE2 PHE A 157 -2.588 6.587 1.241 1.00 1.60 C ATOM 2452 CZ PHE A 157 -1.465 6.093 0.563 1.00 1.80 C ATOM 0 H PHE A 157 -1.746 11.027 1.055 1.00 0.35 H new ATOM 0 HA PHE A 157 -2.015 10.947 -1.882 1.00 0.40 H new ATOM 0 HB2 PHE A 157 -4.217 9.947 -0.116 1.00 0.51 H new ATOM 0 HB3 PHE A 157 -3.825 9.518 -1.769 1.00 0.51 H new ATOM 0 HD1 PHE A 157 -1.078 8.549 -1.701 1.00 0.99 H new ATOM 0 HD2 PHE A 157 -4.141 8.052 1.235 1.00 1.03 H new ATOM 0 HE1 PHE A 157 0.091 6.582 -0.805 1.00 1.55 H new ATOM 0 HE2 PHE A 157 -2.955 6.085 2.124 1.00 1.60 H new ATOM 0 HZ PHE A 157 -1.070 5.117 0.801 1.00 1.80 H new ATOM 2462 N VAL A 158 -3.570 12.908 -1.979 1.00 0.43 N ATOM 2463 CA VAL A 158 -4.381 14.163 -2.104 1.00 0.46 C ATOM 2464 C VAL A 158 -5.791 13.848 -2.711 1.00 0.48 C ATOM 2465 O VAL A 158 -5.943 12.996 -3.607 1.00 0.47 O ATOM 2466 CB VAL A 158 -3.676 15.363 -2.932 1.00 0.50 C ATOM 2467 CG1 VAL A 158 -4.040 16.761 -2.361 1.00 0.58 C ATOM 2468 CG2 VAL A 158 -2.129 15.298 -2.991 1.00 0.58 C ATOM 0 H VAL A 158 -3.151 12.604 -2.858 1.00 0.43 H new ATOM 0 HA VAL A 158 -4.477 14.535 -1.084 1.00 0.46 H new ATOM 0 HB VAL A 158 -4.070 15.223 -3.939 1.00 0.50 H new ATOM 0 HG11 VAL A 158 -3.544 17.534 -2.948 1.00 0.58 H new ATOM 0 HG12 VAL A 158 -5.119 16.904 -2.410 1.00 0.58 H new ATOM 0 HG13 VAL A 158 -3.712 16.827 -1.324 1.00 0.58 H new ATOM 0 HG21 VAL A 158 -1.751 16.143 -3.566 1.00 0.58 H new ATOM 0 HG22 VAL A 158 -1.724 15.338 -1.980 1.00 0.58 H new ATOM 0 HG23 VAL A 158 -1.822 14.368 -3.469 1.00 0.58 H new ATOM 2478 N LYS A 159 -6.791 14.610 -2.203 1.00 0.52 N ATOM 2479 CA LYS A 159 -8.238 14.498 -2.545 1.00 0.56 C ATOM 2480 C LYS A 159 -8.663 15.004 -3.952 1.00 0.66 C ATOM 2481 O LYS A 159 -8.066 15.924 -4.524 1.00 0.81 O ATOM 2482 CB LYS A 159 -9.069 15.271 -1.485 1.00 0.72 C ATOM 2483 CG LYS A 159 -8.727 16.787 -1.375 1.00 1.06 C ATOM 2484 CD LYS A 159 -9.905 17.631 -0.831 1.00 1.48 C ATOM 2485 CE LYS A 159 -9.511 19.094 -0.570 1.00 1.63 C ATOM 2486 NZ LYS A 159 -10.682 19.911 -0.147 1.00 2.18 N ATOM 0 H LYS A 159 -6.610 15.346 -1.520 1.00 0.52 H new ATOM 0 HA LYS A 159 -8.431 13.425 -2.553 1.00 0.56 H new ATOM 0 HB2 LYS A 159 -10.127 15.167 -1.725 1.00 0.72 H new ATOM 0 HB3 LYS A 159 -8.916 14.805 -0.511 1.00 0.72 H new ATOM 0 HG2 LYS A 159 -7.864 16.913 -0.722 1.00 1.06 H new ATOM 0 HG3 LYS A 159 -8.441 17.162 -2.358 1.00 1.06 H new ATOM 0 HD2 LYS A 159 -10.728 17.602 -1.545 1.00 1.48 H new ATOM 0 HD3 LYS A 159 -10.270 17.186 0.095 1.00 1.48 H new ATOM 0 HE2 LYS A 159 -8.742 19.132 0.202 1.00 1.63 H new ATOM 0 HE3 LYS A 159 -9.076 19.521 -1.474 1.00 1.63 H new ATOM 0 HZ1 LYS A 159 -10.379 20.892 0.020 1.00 2.18 H new ATOM 0 HZ2 LYS A 159 -11.405 19.895 -0.895 1.00 2.18 H new ATOM 0 HZ3 LYS A 159 -11.081 19.518 0.729 1.00 2.18 H new ATOM 2500 N GLY A 160 -9.729 14.366 -4.465 1.00 0.74 N ATOM 2501 CA GLY A 160 -10.319 14.716 -5.761 1.00 0.93 C ATOM 2502 C GLY A 160 -11.753 15.267 -5.639 1.00 0.96 C ATOM 2503 O GLY A 160 -12.070 16.300 -6.234 1.00 1.02 O ATOM 0 H GLY A 160 -10.202 13.596 -3.992 1.00 0.74 H new ATOM 0 HA2 GLY A 160 -9.690 15.459 -6.252 1.00 0.93 H new ATOM 0 HA3 GLY A 160 -10.328 13.833 -6.401 1.00 0.93 H new ATOM 2507 N TYR A 161 -12.614 14.566 -4.861 1.00 0.96 N ATOM 2508 CA TYR A 161 -14.013 14.987 -4.637 1.00 1.02 C ATOM 2509 C TYR A 161 -14.395 14.955 -3.132 1.00 1.05 C ATOM 2510 O TYR A 161 -14.459 16.008 -2.492 1.00 1.11 O ATOM 2511 CB TYR A 161 -14.981 14.108 -5.460 1.00 1.14 C ATOM 2512 CG TYR A 161 -15.229 14.614 -6.889 1.00 1.34 C ATOM 2513 CD1 TYR A 161 -14.395 14.234 -7.948 1.00 1.63 C ATOM 2514 CD2 TYR A 161 -16.301 15.464 -7.182 1.00 1.81 C ATOM 2515 CE1 TYR A 161 -14.622 14.685 -9.239 1.00 2.07 C ATOM 2516 CE2 TYR A 161 -16.526 15.914 -8.475 1.00 2.26 C ATOM 2517 CZ TYR A 161 -15.677 15.545 -9.486 1.00 2.29 C ATOM 2518 OH TYR A 161 -15.910 15.969 -10.776 1.00 2.86 O ATOM 0 H TYR A 161 -12.360 13.704 -4.378 1.00 0.96 H new ATOM 0 HA TYR A 161 -14.100 16.020 -4.974 1.00 1.02 H new ATOM 0 HB2 TYR A 161 -14.582 13.095 -5.509 1.00 1.14 H new ATOM 0 HB3 TYR A 161 -15.935 14.049 -4.936 1.00 1.14 H new ATOM 0 HD1 TYR A 161 -13.559 13.577 -7.755 1.00 1.63 H new ATOM 0 HD2 TYR A 161 -16.964 15.775 -6.389 1.00 1.81 H new ATOM 0 HE1 TYR A 161 -13.979 14.367 -10.047 1.00 2.07 H new ATOM 0 HE2 TYR A 161 -17.370 16.555 -8.685 1.00 2.26 H new ATOM 0 HH TYR A 161 -16.686 16.568 -10.788 1.00 2.86 H new ATOM 2528 N TYR A 162 -14.648 13.746 -2.579 1.00 1.09 N ATOM 2529 CA TYR A 162 -15.023 13.573 -1.154 1.00 1.17 C ATOM 2530 C TYR A 162 -14.300 12.356 -0.522 1.00 1.10 C ATOM 2531 O TYR A 162 -13.643 12.488 0.513 1.00 1.71 O ATOM 2532 CB TYR A 162 -16.553 13.420 -1.019 1.00 1.54 C ATOM 2533 CG TYR A 162 -17.123 13.882 0.333 1.00 1.88 C ATOM 2534 CD1 TYR A 162 -17.491 15.215 0.551 1.00 2.57 C ATOM 2535 CD2 TYR A 162 -17.299 12.980 1.389 1.00 2.00 C ATOM 2536 CE1 TYR A 162 -18.009 15.625 1.769 1.00 3.18 C ATOM 2537 CE2 TYR A 162 -17.817 13.394 2.607 1.00 2.64 C ATOM 2538 CZ TYR A 162 -18.149 14.732 2.789 1.00 3.16 C ATOM 2539 OH TYR A 162 -18.684 15.122 3.996 1.00 3.91 O ATOM 0 H TYR A 162 -14.599 12.871 -3.101 1.00 1.09 H new ATOM 0 HA TYR A 162 -14.707 14.465 -0.613 1.00 1.17 H new ATOM 0 HB2 TYR A 162 -17.034 13.988 -1.815 1.00 1.54 H new ATOM 0 HB3 TYR A 162 -16.816 12.373 -1.171 1.00 1.54 H new ATOM 0 HD1 TYR A 162 -17.369 15.936 -0.244 1.00 2.57 H new ATOM 0 HD2 TYR A 162 -17.027 11.944 1.253 1.00 2.00 H new ATOM 0 HE1 TYR A 162 -18.303 16.655 1.910 1.00 3.18 H new ATOM 0 HE2 TYR A 162 -17.961 12.683 3.407 1.00 2.64 H new ATOM 0 HH TYR A 162 -18.709 14.355 4.606 1.00 3.91 H new ATOM 2549 N ASP A 163 -14.440 11.169 -1.167 1.00 1.04 N ATOM 2550 CA ASP A 163 -13.795 9.894 -0.743 1.00 0.99 C ATOM 2551 C ASP A 163 -12.436 9.724 -1.418 1.00 1.06 C ATOM 2552 O ASP A 163 -12.335 9.671 -2.641 1.00 1.74 O ATOM 2553 CB ASP A 163 -14.692 8.697 -1.100 1.00 1.11 C ATOM 2554 CG ASP A 163 -15.546 8.227 0.070 1.00 1.19 C ATOM 2555 OD1 ASP A 163 -15.036 7.453 0.905 1.00 1.27 O ATOM 2556 OD2 ASP A 163 -16.724 8.637 0.147 1.00 1.34 O ATOM 0 H ASP A 163 -15.010 11.067 -2.006 1.00 1.04 H new ATOM 0 HA ASP A 163 -13.653 9.933 0.337 1.00 0.99 H new ATOM 0 HB2 ASP A 163 -15.342 8.972 -1.931 1.00 1.11 H new ATOM 0 HB3 ASP A 163 -14.068 7.871 -1.443 1.00 1.11 H new ATOM 2561 N ASN A 164 -11.397 9.639 -0.566 1.00 0.83 N ATOM 2562 CA ASN A 164 -9.977 9.445 -0.972 1.00 0.83 C ATOM 2563 C ASN A 164 -9.691 7.928 -1.269 1.00 1.01 C ATOM 2564 O ASN A 164 -10.655 7.150 -1.365 1.00 1.68 O ATOM 2565 CB ASN A 164 -9.116 9.966 0.202 1.00 1.02 C ATOM 2566 CG ASN A 164 -8.196 11.135 -0.156 1.00 0.88 C ATOM 2567 OD1 ASN A 164 -7.822 11.325 -1.314 1.00 1.57 O ATOM 2568 ND2 ASN A 164 -7.823 11.917 0.854 1.00 0.82 N ATOM 0 H ASN A 164 -11.515 9.704 0.445 1.00 0.83 H new ATOM 0 HA ASN A 164 -9.744 9.986 -1.889 1.00 0.83 H new ATOM 0 HB2 ASN A 164 -9.777 10.275 1.012 1.00 1.02 H new ATOM 0 HB3 ASN A 164 -8.508 9.145 0.583 1.00 1.02 H new ATOM 0 HD21 ASN A 164 -7.204 12.710 0.684 1.00 0.82 H new ATOM 0 HD22 ASN A 164 -8.156 11.724 1.798 1.00 0.82 H new ATOM 2575 N PRO A 165 -8.403 7.441 -1.483 1.00 0.87 N ATOM 2576 CA PRO A 165 -8.128 5.970 -1.686 1.00 1.06 C ATOM 2577 C PRO A 165 -8.530 5.123 -0.452 1.00 0.93 C ATOM 2578 O PRO A 165 -7.863 5.140 0.588 1.00 1.76 O ATOM 2579 CB PRO A 165 -6.613 5.922 -1.922 1.00 1.45 C ATOM 2580 CG PRO A 165 -6.289 7.281 -2.466 1.00 2.06 C ATOM 2581 CD PRO A 165 -7.156 8.230 -1.664 1.00 1.41 C ATOM 0 HA PRO A 165 -8.707 5.550 -2.509 1.00 1.06 H new ATOM 0 HB2 PRO A 165 -6.071 5.722 -0.998 1.00 1.45 H new ATOM 0 HB3 PRO A 165 -6.343 5.135 -2.626 1.00 1.45 H new ATOM 0 HG2 PRO A 165 -5.231 7.514 -2.347 1.00 2.06 H new ATOM 0 HG3 PRO A 165 -6.511 7.345 -3.531 1.00 2.06 H new ATOM 0 HD2 PRO A 165 -6.698 8.492 -0.710 1.00 1.41 H new ATOM 0 HD3 PRO A 165 -7.339 9.163 -2.197 1.00 1.41 H new ATOM 2589 N LYS A 166 -9.677 4.413 -0.619 1.00 0.54 N ATOM 2590 CA LYS A 166 -10.363 3.613 0.439 1.00 0.47 C ATOM 2591 C LYS A 166 -9.531 2.454 1.082 1.00 0.42 C ATOM 2592 O LYS A 166 -9.244 2.524 2.279 1.00 0.47 O ATOM 2593 CB LYS A 166 -11.726 3.066 -0.079 1.00 0.82 C ATOM 2594 CG LYS A 166 -11.740 2.578 -1.557 1.00 1.30 C ATOM 2595 CD LYS A 166 -12.152 3.683 -2.572 1.00 1.83 C ATOM 2596 CE LYS A 166 -13.677 3.793 -2.746 1.00 2.33 C ATOM 2597 NZ LYS A 166 -14.246 2.587 -3.407 1.00 3.00 N ATOM 0 H LYS A 166 -10.165 4.378 -1.514 1.00 0.54 H new ATOM 0 HA LYS A 166 -10.512 4.327 1.249 1.00 0.47 H new ATOM 0 HB2 LYS A 166 -12.031 2.238 0.561 1.00 0.82 H new ATOM 0 HB3 LYS A 166 -12.477 3.848 0.033 1.00 0.82 H new ATOM 0 HG2 LYS A 166 -10.749 2.207 -1.818 1.00 1.30 H new ATOM 0 HG3 LYS A 166 -12.429 1.738 -1.647 1.00 1.30 H new ATOM 0 HD2 LYS A 166 -11.759 4.643 -2.237 1.00 1.83 H new ATOM 0 HD3 LYS A 166 -11.695 3.471 -3.539 1.00 1.83 H new ATOM 0 HE2 LYS A 166 -14.145 3.928 -1.771 1.00 2.33 H new ATOM 0 HE3 LYS A 166 -13.912 4.677 -3.338 1.00 2.33 H new ATOM 0 HZ1 LYS A 166 -14.855 2.879 -4.198 1.00 3.00 H new ATOM 0 HZ2 LYS A 166 -13.473 1.991 -3.767 1.00 3.00 H new ATOM 0 HZ3 LYS A 166 -14.808 2.046 -2.719 1.00 3.00 H new ATOM 2611 N VAL A 167 -9.124 1.405 0.300 1.00 0.39 N ATOM 2612 CA VAL A 167 -8.307 0.279 0.878 1.00 0.38 C ATOM 2613 C VAL A 167 -6.799 0.526 0.610 1.00 0.34 C ATOM 2614 O VAL A 167 -6.385 0.707 -0.551 1.00 0.33 O ATOM 2615 CB VAL A 167 -8.779 -1.175 0.344 1.00 0.45 C ATOM 2616 CG1 VAL A 167 -7.960 -2.380 0.906 1.00 0.80 C ATOM 2617 CG2 VAL A 167 -10.261 -1.468 0.668 1.00 0.58 C ATOM 0 H VAL A 167 -9.336 1.312 -0.693 1.00 0.39 H new ATOM 0 HA VAL A 167 -8.475 0.268 1.955 1.00 0.38 H new ATOM 0 HB VAL A 167 -8.608 -1.099 -0.730 1.00 0.45 H new ATOM 0 HG11 VAL A 167 -8.350 -3.310 0.492 1.00 0.80 H new ATOM 0 HG12 VAL A 167 -6.912 -2.269 0.627 1.00 0.80 H new ATOM 0 HG13 VAL A 167 -8.046 -2.403 1.992 1.00 0.80 H new ATOM 0 HG21 VAL A 167 -10.528 -2.455 0.289 1.00 0.58 H new ATOM 0 HG22 VAL A 167 -10.410 -1.441 1.747 1.00 0.58 H new ATOM 0 HG23 VAL A 167 -10.892 -0.715 0.196 1.00 0.58 H new ATOM 2627 N CYS A 168 -6.000 0.377 1.704 1.00 0.35 N ATOM 2628 CA CYS A 168 -4.558 0.607 1.628 1.00 0.35 C ATOM 2629 C CYS A 168 -3.762 -0.511 2.327 1.00 0.36 C ATOM 2630 O CYS A 168 -3.946 -0.792 3.510 1.00 0.48 O ATOM 2631 CB CYS A 168 -4.235 1.987 2.226 1.00 0.37 C ATOM 2632 SG CYS A 168 -5.485 2.638 3.362 1.00 0.87 S ATOM 0 H CYS A 168 -6.338 0.103 2.627 1.00 0.35 H new ATOM 0 HA CYS A 168 -4.254 0.591 0.581 1.00 0.35 H new ATOM 0 HB2 CYS A 168 -3.283 1.924 2.754 1.00 0.37 H new ATOM 0 HB3 CYS A 168 -4.101 2.698 1.410 1.00 0.37 H new ATOM 0 HG CYS A 168 -5.106 3.800 3.804 1.00 0.87 H new ATOM 2638 N ALA A 169 -2.859 -1.133 1.541 1.00 0.29 N ATOM 2639 CA ALA A 169 -2.021 -2.291 1.958 1.00 0.29 C ATOM 2640 C ALA A 169 -0.454 -2.067 1.880 1.00 0.25 C ATOM 2641 O ALA A 169 0.267 -2.823 1.190 1.00 0.26 O ATOM 2642 CB ALA A 169 -2.503 -3.605 1.296 1.00 0.34 C ATOM 0 H ALA A 169 -2.684 -0.843 0.579 1.00 0.29 H new ATOM 0 HA ALA A 169 -2.184 -2.391 3.031 1.00 0.29 H new ATOM 0 HB1 ALA A 169 -1.870 -4.430 1.622 1.00 0.34 H new ATOM 0 HB2 ALA A 169 -3.535 -3.802 1.588 1.00 0.34 H new ATOM 0 HB3 ALA A 169 -2.445 -3.509 0.212 1.00 0.34 H new ATOM 2648 N LEU A 170 0.050 -0.903 2.434 1.00 0.22 N ATOM 2649 CA LEU A 170 1.519 -0.491 2.472 1.00 0.21 C ATOM 2650 C LEU A 170 2.540 -1.587 2.890 1.00 0.19 C ATOM 2651 O LEU A 170 2.357 -2.284 3.892 1.00 0.34 O ATOM 2652 CB LEU A 170 1.712 0.677 3.465 1.00 0.31 C ATOM 2653 CG LEU A 170 2.026 2.105 2.918 1.00 0.38 C ATOM 2654 CD1 LEU A 170 3.217 2.134 1.949 1.00 0.50 C ATOM 2655 CD2 LEU A 170 0.798 2.736 2.259 1.00 0.70 C ATOM 0 H LEU A 170 -0.558 -0.212 2.874 1.00 0.22 H new ATOM 0 HA LEU A 170 1.731 -0.235 1.434 1.00 0.21 H new ATOM 0 HB2 LEU A 170 0.805 0.749 4.065 1.00 0.31 H new ATOM 0 HB3 LEU A 170 2.521 0.401 4.141 1.00 0.31 H new ATOM 0 HG LEU A 170 2.306 2.697 3.789 1.00 0.38 H new ATOM 0 HD11 LEU A 170 3.382 3.155 1.606 1.00 0.50 H new ATOM 0 HD12 LEU A 170 4.110 1.774 2.459 1.00 0.50 H new ATOM 0 HD13 LEU A 170 3.005 1.493 1.093 1.00 0.50 H new ATOM 0 HD21 LEU A 170 1.053 3.729 1.890 1.00 0.70 H new ATOM 0 HD22 LEU A 170 0.471 2.113 1.427 1.00 0.70 H new ATOM 0 HD23 LEU A 170 -0.006 2.816 2.990 1.00 0.70 H new ATOM 2667 N PHE A 171 3.609 -1.705 2.091 1.00 0.16 N ATOM 2668 CA PHE A 171 4.667 -2.691 2.326 1.00 0.14 C ATOM 2669 C PHE A 171 6.030 -2.189 1.775 1.00 0.14 C ATOM 2670 O PHE A 171 6.239 -2.190 0.559 1.00 0.19 O ATOM 2671 CB PHE A 171 4.228 -4.029 1.642 1.00 0.17 C ATOM 2672 CG PHE A 171 5.284 -5.129 1.483 1.00 0.16 C ATOM 2673 CD1 PHE A 171 6.266 -5.317 2.462 1.00 0.15 C ATOM 2674 CD2 PHE A 171 5.303 -5.969 0.369 1.00 0.20 C ATOM 2675 CE1 PHE A 171 7.223 -6.304 2.327 1.00 0.15 C ATOM 2676 CE2 PHE A 171 6.257 -6.951 0.240 1.00 0.21 C ATOM 2677 CZ PHE A 171 7.192 -7.135 1.175 1.00 0.17 C ATOM 0 H PHE A 171 3.762 -1.122 1.268 1.00 0.16 H new ATOM 0 HA PHE A 171 4.808 -2.850 3.395 1.00 0.14 H new ATOM 0 HB2 PHE A 171 3.398 -4.442 2.215 1.00 0.17 H new ATOM 0 HB3 PHE A 171 3.843 -3.788 0.651 1.00 0.17 H new ATOM 0 HD1 PHE A 171 6.276 -4.682 3.335 1.00 0.15 H new ATOM 0 HD2 PHE A 171 4.558 -5.846 -0.403 1.00 0.20 H new ATOM 0 HE1 PHE A 171 7.981 -6.442 3.084 1.00 0.15 H new ATOM 0 HE2 PHE A 171 6.250 -7.585 -0.634 1.00 0.21 H new ATOM 0 HZ PHE A 171 7.927 -7.918 1.055 1.00 0.17 H new ATOM 2687 N ILE A 172 6.958 -1.761 2.671 1.00 0.10 N ATOM 2688 CA ILE A 172 8.309 -1.362 2.213 1.00 0.10 C ATOM 2689 C ILE A 172 9.412 -2.352 2.754 1.00 0.08 C ATOM 2690 O ILE A 172 9.589 -2.557 3.992 1.00 0.08 O ATOM 2691 CB ILE A 172 8.708 0.198 2.395 1.00 0.13 C ATOM 2692 CG1 ILE A 172 9.919 0.528 1.384 1.00 0.14 C ATOM 2693 CG2 ILE A 172 8.984 0.617 3.883 1.00 0.22 C ATOM 2694 CD1 ILE A 172 10.494 1.969 1.331 1.00 0.31 C ATOM 0 H ILE A 172 6.803 -1.686 3.676 1.00 0.10 H new ATOM 0 HA ILE A 172 8.262 -1.455 1.128 1.00 0.10 H new ATOM 0 HB ILE A 172 7.850 0.817 2.133 1.00 0.13 H new ATOM 0 HG12 ILE A 172 10.742 -0.144 1.628 1.00 0.14 H new ATOM 0 HG13 ILE A 172 9.585 0.271 0.379 1.00 0.14 H new ATOM 0 HG21 ILE A 172 9.245 1.675 3.921 1.00 0.22 H new ATOM 0 HG22 ILE A 172 8.090 0.442 4.482 1.00 0.22 H new ATOM 0 HG23 ILE A 172 9.809 0.026 4.280 1.00 0.22 H new ATOM 0 HD11 ILE A 172 11.301 2.012 0.599 1.00 0.31 H new ATOM 0 HD12 ILE A 172 9.706 2.665 1.044 1.00 0.31 H new ATOM 0 HD13 ILE A 172 10.880 2.243 2.313 1.00 0.31 H new ATOM 2706 N MET A 173 10.139 -2.929 1.794 1.00 0.09 N ATOM 2707 CA MET A 173 11.229 -3.872 2.069 1.00 0.11 C ATOM 2708 C MET A 173 12.559 -3.373 1.446 1.00 0.13 C ATOM 2709 O MET A 173 12.554 -2.475 0.589 1.00 0.21 O ATOM 2710 CB MET A 173 10.849 -5.295 1.586 1.00 0.15 C ATOM 2711 CG MET A 173 10.234 -5.359 0.167 1.00 0.17 C ATOM 2712 SD MET A 173 11.460 -5.287 -1.158 1.00 0.44 S ATOM 2713 CE MET A 173 12.430 -6.758 -0.836 1.00 0.26 C ATOM 0 H MET A 173 9.989 -2.755 0.800 1.00 0.09 H new ATOM 0 HA MET A 173 11.385 -3.927 3.146 1.00 0.11 H new ATOM 0 HB2 MET A 173 11.741 -5.921 1.608 1.00 0.15 H new ATOM 0 HB3 MET A 173 10.140 -5.726 2.293 1.00 0.15 H new ATOM 0 HG2 MET A 173 9.661 -6.281 0.070 1.00 0.17 H new ATOM 0 HG3 MET A 173 9.533 -4.533 0.047 1.00 0.17 H new ATOM 0 HE1 MET A 173 12.890 -7.101 -1.763 1.00 0.26 H new ATOM 0 HE2 MET A 173 13.208 -6.529 -0.108 1.00 0.26 H new ATOM 0 HE3 MET A 173 11.783 -7.541 -0.441 1.00 0.26 H new ATOM 2723 N LYS A 174 13.705 -3.952 1.854 1.00 0.12 N ATOM 2724 CA LYS A 174 14.994 -3.444 1.358 1.00 0.19 C ATOM 2725 C LYS A 174 15.934 -4.428 0.610 1.00 0.16 C ATOM 2726 O LYS A 174 15.874 -5.656 0.722 1.00 0.17 O ATOM 2727 CB LYS A 174 15.769 -2.771 2.534 1.00 0.38 C ATOM 2728 CG LYS A 174 16.512 -3.758 3.469 1.00 0.54 C ATOM 2729 CD LYS A 174 17.207 -3.077 4.678 1.00 0.57 C ATOM 2730 CE LYS A 174 18.478 -2.297 4.297 1.00 0.49 C ATOM 2731 NZ LYS A 174 19.223 -1.855 5.505 1.00 1.26 N ATOM 0 H LYS A 174 13.765 -4.740 2.499 1.00 0.12 H new ATOM 0 HA LYS A 174 14.704 -2.741 0.577 1.00 0.19 H new ATOM 0 HB2 LYS A 174 16.493 -2.070 2.120 1.00 0.38 H new ATOM 0 HB3 LYS A 174 15.065 -2.189 3.129 1.00 0.38 H new ATOM 0 HG2 LYS A 174 15.801 -4.497 3.840 1.00 0.54 H new ATOM 0 HG3 LYS A 174 17.260 -4.299 2.889 1.00 0.54 H new ATOM 0 HD2 LYS A 174 16.502 -2.396 5.156 1.00 0.57 H new ATOM 0 HD3 LYS A 174 17.465 -3.838 5.415 1.00 0.57 H new ATOM 0 HE2 LYS A 174 19.121 -2.925 3.680 1.00 0.49 H new ATOM 0 HE3 LYS A 174 18.208 -1.429 3.696 1.00 0.49 H new ATOM 0 HZ1 LYS A 174 20.074 -1.332 5.216 1.00 1.26 H new ATOM 0 HZ2 LYS A 174 18.616 -1.237 6.080 1.00 1.26 H new ATOM 0 HZ3 LYS A 174 19.501 -2.686 6.065 1.00 1.26 H new ATOM 2745 N GLY A 175 16.802 -3.755 -0.148 1.00 0.14 N ATOM 2746 CA GLY A 175 17.926 -4.307 -0.911 1.00 0.15 C ATOM 2747 C GLY A 175 17.799 -4.453 -2.440 1.00 0.13 C ATOM 2748 O GLY A 175 18.712 -3.953 -3.112 1.00 0.17 O ATOM 0 H GLY A 175 16.735 -2.743 -0.253 1.00 0.14 H new ATOM 0 HA2 GLY A 175 18.796 -3.681 -0.713 1.00 0.15 H new ATOM 0 HA3 GLY A 175 18.145 -5.294 -0.504 1.00 0.15 H new ATOM 2752 N THR A 176 16.624 -4.904 -3.005 1.00 0.11 N ATOM 2753 CA THR A 176 16.450 -5.098 -4.500 1.00 0.10 C ATOM 2754 C THR A 176 15.017 -5.532 -4.897 1.00 0.10 C ATOM 2755 O THR A 176 14.288 -6.152 -4.112 1.00 0.13 O ATOM 2756 CB THR A 176 17.409 -6.177 -5.161 1.00 0.12 C ATOM 2757 OG1 THR A 176 17.899 -7.146 -4.209 1.00 0.15 O ATOM 2758 CG2 THR A 176 18.604 -5.557 -5.923 1.00 0.15 C ATOM 0 H THR A 176 15.794 -5.137 -2.460 1.00 0.11 H new ATOM 0 HA THR A 176 16.697 -4.104 -4.873 1.00 0.10 H new ATOM 0 HB THR A 176 16.776 -6.687 -5.887 1.00 0.12 H new ATOM 0 HG1 THR A 176 18.482 -7.787 -4.666 1.00 0.15 H new ATOM 0 HG21 THR A 176 19.216 -6.352 -6.348 1.00 0.15 H new ATOM 0 HG22 THR A 176 18.233 -4.917 -6.724 1.00 0.15 H new ATOM 0 HG23 THR A 176 19.206 -4.964 -5.235 1.00 0.15 H new ATOM 2766 N ALA A 177 14.637 -5.205 -6.177 1.00 0.10 N ATOM 2767 CA ALA A 177 13.323 -5.575 -6.800 1.00 0.11 C ATOM 2768 C ALA A 177 13.260 -7.060 -7.340 1.00 0.15 C ATOM 2769 O ALA A 177 12.169 -7.589 -7.608 1.00 0.17 O ATOM 2770 CB ALA A 177 12.996 -4.569 -7.931 1.00 0.15 C ATOM 0 H ALA A 177 15.239 -4.674 -6.806 1.00 0.10 H new ATOM 0 HA ALA A 177 12.573 -5.524 -6.011 1.00 0.11 H new ATOM 0 HB1 ALA A 177 12.042 -4.833 -8.388 1.00 0.15 H new ATOM 0 HB2 ALA A 177 12.934 -3.563 -7.516 1.00 0.15 H new ATOM 0 HB3 ALA A 177 13.781 -4.603 -8.686 1.00 0.15 H new ATOM 2776 N ASP A 178 14.441 -7.733 -7.469 1.00 0.19 N ATOM 2777 CA ASP A 178 14.542 -9.153 -7.927 1.00 0.24 C ATOM 2778 C ASP A 178 14.425 -10.212 -6.770 1.00 0.26 C ATOM 2779 O ASP A 178 14.542 -11.415 -7.019 1.00 0.31 O ATOM 2780 CB ASP A 178 15.868 -9.365 -8.678 1.00 0.31 C ATOM 2781 CG ASP A 178 15.742 -9.180 -10.187 1.00 0.42 C ATOM 2782 OD1 ASP A 178 15.381 -10.158 -10.877 1.00 0.55 O ATOM 2783 OD2 ASP A 178 16.003 -8.059 -10.674 1.00 0.51 O ATOM 0 H ASP A 178 15.345 -7.309 -7.260 1.00 0.19 H new ATOM 0 HA ASP A 178 13.688 -9.317 -8.584 1.00 0.24 H new ATOM 0 HB2 ASP A 178 16.611 -8.666 -8.294 1.00 0.31 H new ATOM 0 HB3 ASP A 178 16.238 -10.369 -8.472 1.00 0.31 H new ATOM 2788 N ASP A 179 14.187 -9.743 -5.519 1.00 0.24 N ATOM 2789 CA ASP A 179 14.047 -10.619 -4.324 1.00 0.31 C ATOM 2790 C ASP A 179 12.593 -10.682 -3.758 1.00 0.32 C ATOM 2791 O ASP A 179 12.336 -11.439 -2.822 1.00 0.44 O ATOM 2792 CB ASP A 179 14.995 -10.143 -3.213 1.00 0.37 C ATOM 2793 CG ASP A 179 16.356 -10.833 -3.243 1.00 0.48 C ATOM 2794 OD1 ASP A 179 17.244 -10.364 -3.986 1.00 0.52 O ATOM 2795 OD2 ASP A 179 16.528 -11.838 -2.523 1.00 0.60 O ATOM 0 H ASP A 179 14.087 -8.750 -5.309 1.00 0.24 H new ATOM 0 HA ASP A 179 14.305 -11.625 -4.655 1.00 0.31 H new ATOM 0 HB2 ASP A 179 15.139 -9.066 -3.305 1.00 0.37 H new ATOM 0 HB3 ASP A 179 14.527 -10.321 -2.245 1.00 0.37 H new ATOM 2800 N VAL A 180 11.665 -9.861 -4.321 1.00 0.24 N ATOM 2801 CA VAL A 180 10.209 -9.815 -3.918 1.00 0.29 C ATOM 2802 C VAL A 180 9.343 -10.856 -4.732 1.00 0.50 C ATOM 2803 O VAL A 180 8.891 -10.535 -5.838 1.00 0.95 O ATOM 2804 CB VAL A 180 9.489 -8.375 -4.075 1.00 0.27 C ATOM 2805 CG1 VAL A 180 8.921 -7.877 -2.733 1.00 0.48 C ATOM 2806 CG2 VAL A 180 10.356 -7.234 -4.676 1.00 0.50 C ATOM 0 H VAL A 180 11.894 -9.207 -5.069 1.00 0.24 H new ATOM 0 HA VAL A 180 10.245 -10.058 -2.856 1.00 0.29 H new ATOM 0 HB VAL A 180 8.701 -8.583 -4.798 1.00 0.27 H new ATOM 0 HG11 VAL A 180 8.445 -6.907 -2.877 1.00 0.48 H new ATOM 0 HG12 VAL A 180 8.186 -8.591 -2.362 1.00 0.48 H new ATOM 0 HG13 VAL A 180 9.730 -7.780 -2.009 1.00 0.48 H new ATOM 0 HG21 VAL A 180 9.766 -6.319 -4.732 1.00 0.50 H new ATOM 0 HG22 VAL A 180 11.227 -7.066 -4.042 1.00 0.50 H new ATOM 0 HG23 VAL A 180 10.685 -7.515 -5.677 1.00 0.50 H new ATOM 2816 N PRO A 181 9.105 -12.120 -4.212 1.00 0.59 N ATOM 2817 CA PRO A 181 8.286 -13.143 -4.914 1.00 0.75 C ATOM 2818 C PRO A 181 6.798 -13.191 -4.481 1.00 1.31 C ATOM 2819 O PRO A 181 6.472 -12.943 -3.317 1.00 1.80 O ATOM 2820 CB PRO A 181 9.006 -14.441 -4.521 1.00 1.20 C ATOM 2821 CG PRO A 181 9.485 -14.199 -3.104 1.00 1.57 C ATOM 2822 CD PRO A 181 9.666 -12.684 -2.954 1.00 1.05 C ATOM 0 HA PRO A 181 8.222 -12.943 -5.984 1.00 0.75 H new ATOM 0 HB2 PRO A 181 8.334 -15.298 -4.571 1.00 1.20 H new ATOM 0 HB3 PRO A 181 9.840 -14.650 -5.191 1.00 1.20 H new ATOM 0 HG2 PRO A 181 8.762 -14.576 -2.381 1.00 1.57 H new ATOM 0 HG3 PRO A 181 10.423 -14.721 -2.918 1.00 1.57 H new ATOM 0 HD2 PRO A 181 9.139 -12.305 -2.078 1.00 1.05 H new ATOM 0 HD3 PRO A 181 10.716 -12.419 -2.833 1.00 1.05 H new ATOM 2830 N MET A 182 5.915 -13.514 -5.445 1.00 1.54 N ATOM 2831 CA MET A 182 4.463 -13.605 -5.197 1.00 2.26 C ATOM 2832 C MET A 182 3.849 -14.828 -5.900 1.00 2.40 C ATOM 2833 O MET A 182 3.775 -14.880 -7.133 1.00 2.49 O ATOM 2834 CB MET A 182 3.745 -12.322 -5.672 1.00 2.82 C ATOM 2835 CG MET A 182 4.012 -11.076 -4.806 1.00 3.46 C ATOM 2836 SD MET A 182 3.306 -11.218 -3.150 1.00 4.01 S ATOM 2837 CE MET A 182 3.876 -9.697 -2.392 1.00 4.96 C ATOM 0 H MET A 182 6.184 -13.717 -6.408 1.00 1.54 H new ATOM 0 HA MET A 182 4.325 -13.717 -4.122 1.00 2.26 H new ATOM 0 HB2 MET A 182 4.052 -12.108 -6.696 1.00 2.82 H new ATOM 0 HB3 MET A 182 2.671 -12.510 -5.693 1.00 2.82 H new ATOM 0 HG2 MET A 182 5.087 -10.917 -4.726 1.00 3.46 H new ATOM 0 HG3 MET A 182 3.596 -10.198 -5.300 1.00 3.46 H new ATOM 0 HE1 MET A 182 3.516 -9.646 -1.364 1.00 4.96 H new ATOM 0 HE2 MET A 182 4.966 -9.674 -2.397 1.00 4.96 H new ATOM 0 HE3 MET A 182 3.493 -8.845 -2.953 1.00 4.96 H new ATOM 2847 N LEU A 183 3.410 -15.808 -5.092 1.00 2.65 N ATOM 2848 CA LEU A 183 2.793 -17.047 -5.610 1.00 2.86 C ATOM 2849 C LEU A 183 1.582 -17.508 -4.765 1.00 3.61 C ATOM 2850 O LEU A 183 1.410 -17.123 -3.601 1.00 4.00 O ATOM 2851 CB LEU A 183 3.841 -18.202 -5.705 1.00 2.51 C ATOM 2852 CG LEU A 183 4.630 -18.544 -4.401 1.00 2.24 C ATOM 2853 CD1 LEU A 183 4.577 -20.041 -4.089 1.00 2.43 C ATOM 2854 CD2 LEU A 183 6.091 -18.092 -4.488 1.00 2.58 C ATOM 0 H LEU A 183 3.470 -15.768 -4.075 1.00 2.65 H new ATOM 0 HA LEU A 183 2.428 -16.809 -6.609 1.00 2.86 H new ATOM 0 HB2 LEU A 183 3.325 -19.103 -6.036 1.00 2.51 H new ATOM 0 HB3 LEU A 183 4.562 -17.944 -6.481 1.00 2.51 H new ATOM 0 HG LEU A 183 4.143 -17.998 -3.593 1.00 2.24 H new ATOM 0 HD11 LEU A 183 5.136 -20.242 -3.175 1.00 2.43 H new ATOM 0 HD12 LEU A 183 3.540 -20.348 -3.955 1.00 2.43 H new ATOM 0 HD13 LEU A 183 5.017 -20.601 -4.914 1.00 2.43 H new ATOM 0 HD21 LEU A 183 6.607 -18.347 -3.562 1.00 2.58 H new ATOM 0 HD22 LEU A 183 6.578 -18.593 -5.325 1.00 2.58 H new ATOM 0 HD23 LEU A 183 6.130 -17.013 -4.639 1.00 2.58 H new ATOM 2866 N GLN A 184 0.755 -18.365 -5.387 1.00 3.87 N ATOM 2867 CA GLN A 184 -0.450 -18.945 -4.755 1.00 4.58 C ATOM 2868 C GLN A 184 -0.268 -20.474 -4.507 1.00 4.68 C ATOM 2869 O GLN A 184 0.612 -21.088 -5.131 1.00 4.25 O ATOM 2870 CB GLN A 184 -1.665 -18.700 -5.675 1.00 4.95 C ATOM 2871 CG GLN A 184 -2.147 -17.243 -5.720 1.00 5.32 C ATOM 2872 CD GLN A 184 -3.251 -17.028 -6.740 1.00 5.82 C ATOM 2873 OE1 GLN A 184 -4.434 -17.152 -6.425 1.00 6.06 O ATOM 2874 NE2 GLN A 184 -2.867 -16.703 -7.969 1.00 6.27 N ATOM 0 H GLN A 184 0.901 -18.679 -6.347 1.00 3.87 H new ATOM 0 HA GLN A 184 -0.611 -18.465 -3.790 1.00 4.58 H new ATOM 0 HB2 GLN A 184 -1.408 -19.016 -6.686 1.00 4.95 H new ATOM 0 HB3 GLN A 184 -2.489 -19.332 -5.343 1.00 4.95 H new ATOM 0 HG2 GLN A 184 -2.507 -16.952 -4.733 1.00 5.32 H new ATOM 0 HG3 GLN A 184 -1.305 -16.592 -5.957 1.00 5.32 H new ATOM 0 HE21 GLN A 184 -1.875 -16.611 -8.186 1.00 6.27 H new ATOM 0 HE22 GLN A 184 -3.565 -16.545 -8.696 1.00 6.27 H new ATOM 2883 N PRO A 185 -1.080 -21.148 -3.591 1.00 5.36 N ATOM 2884 CA PRO A 185 -0.957 -22.632 -3.324 1.00 5.62 C ATOM 2885 C PRO A 185 -1.299 -23.540 -4.533 1.00 5.52 C ATOM 2886 O PRO A 185 -2.412 -23.501 -5.068 1.00 5.77 O ATOM 2887 CB PRO A 185 -1.985 -22.889 -2.201 1.00 6.42 C ATOM 2888 CG PRO A 185 -2.208 -21.548 -1.569 1.00 6.59 C ATOM 2889 CD PRO A 185 -2.110 -20.544 -2.703 1.00 5.99 C ATOM 0 HA PRO A 185 0.077 -22.876 -3.079 1.00 5.62 H new ATOM 0 HB2 PRO A 185 -2.913 -23.297 -2.601 1.00 6.42 H new ATOM 0 HB3 PRO A 185 -1.606 -23.610 -1.476 1.00 6.42 H new ATOM 0 HG2 PRO A 185 -3.184 -21.500 -1.085 1.00 6.59 H new ATOM 0 HG3 PRO A 185 -1.461 -21.347 -0.801 1.00 6.59 H new ATOM 0 HD2 PRO A 185 -3.064 -20.419 -3.216 1.00 5.99 H new ATOM 0 HD3 PRO A 185 -1.809 -19.559 -2.346 1.00 5.99 H new ATOM 2897 N HIS A 186 -0.303 -24.342 -4.935 1.00 5.25 N ATOM 2898 CA HIS A 186 -0.424 -25.256 -6.081 1.00 5.19 C ATOM 2899 C HIS A 186 0.198 -26.656 -5.753 1.00 5.51 C ATOM 2900 O HIS A 186 1.245 -26.719 -5.093 1.00 5.51 O ATOM 2901 CB HIS A 186 0.278 -24.603 -7.303 1.00 4.55 C ATOM 2902 CG HIS A 186 -0.178 -25.119 -8.646 1.00 4.63 C ATOM 2903 ND1 HIS A 186 0.144 -26.373 -9.110 1.00 4.77 N ATOM 2904 CD2 HIS A 186 -0.980 -24.570 -9.594 1.00 4.82 C ATOM 2905 CE1 HIS A 186 -0.436 -26.583 -10.270 1.00 4.89 C ATOM 2906 NE2 HIS A 186 -1.124 -25.502 -10.593 1.00 4.96 N ATOM 0 H HIS A 186 0.607 -24.376 -4.476 1.00 5.25 H new ATOM 0 HA HIS A 186 -1.477 -25.424 -6.309 1.00 5.19 H new ATOM 0 HB2 HIS A 186 0.111 -23.526 -7.268 1.00 4.55 H new ATOM 0 HB3 HIS A 186 1.353 -24.762 -7.214 1.00 4.55 H new ATOM 0 HD2 HIS A 186 -1.422 -23.585 -9.568 1.00 4.82 H new ATOM 0 HE1 HIS A 186 -0.363 -27.485 -10.859 1.00 4.89 H new ATOM 0 HE2 HIS A 186 -1.672 -25.380 -11.444 1.00 4.96 H new ATOM 2915 N PRO A 187 -0.416 -27.817 -6.219 1.00 5.90 N ATOM 2916 CA PRO A 187 0.122 -29.199 -5.947 1.00 6.31 C ATOM 2917 C PRO A 187 1.316 -29.656 -6.832 1.00 6.06 C ATOM 2918 O PRO A 187 2.137 -30.468 -6.397 1.00 5.96 O ATOM 2919 CB PRO A 187 -1.096 -30.086 -6.258 1.00 6.77 C ATOM 2920 CG PRO A 187 -1.781 -29.355 -7.373 1.00 6.43 C ATOM 2921 CD PRO A 187 -1.709 -27.904 -6.971 1.00 6.09 C ATOM 0 HA PRO A 187 0.526 -29.248 -4.936 1.00 6.31 H new ATOM 0 HB2 PRO A 187 -0.796 -31.089 -6.560 1.00 6.77 H new ATOM 0 HB3 PRO A 187 -1.746 -30.195 -5.390 1.00 6.77 H new ATOM 0 HG2 PRO A 187 -1.283 -29.528 -8.327 1.00 6.43 H new ATOM 0 HG3 PRO A 187 -2.814 -29.684 -7.489 1.00 6.43 H new ATOM 0 HD2 PRO A 187 -1.714 -27.245 -7.840 1.00 6.09 H new ATOM 0 HD3 PRO A 187 -2.556 -27.617 -6.348 1.00 6.09 H new ATOM 2929 N GLY A 188 1.384 -29.124 -8.063 1.00 6.19 N ATOM 2930 CA GLY A 188 2.445 -29.496 -8.996 1.00 6.09 C ATOM 2931 C GLY A 188 3.085 -28.314 -9.727 1.00 6.57 C ATOM 2932 O GLY A 188 3.332 -27.254 -9.135 1.00 7.02 O ATOM 0 H GLY A 188 0.720 -28.441 -8.428 1.00 6.19 H new ATOM 0 HA2 GLY A 188 3.221 -30.033 -8.450 1.00 6.09 H new ATOM 0 HA3 GLY A 188 2.038 -30.187 -9.734 1.00 6.09 H new ATOM 2936 N LEU A 189 3.375 -28.517 -11.026 1.00 6.77 N ATOM 2937 CA LEU A 189 3.996 -27.480 -11.875 1.00 7.51 C ATOM 2938 C LEU A 189 3.098 -27.095 -13.067 1.00 7.90 C ATOM 2939 O LEU A 189 2.830 -27.918 -13.952 1.00 7.97 O ATOM 2940 CB LEU A 189 5.370 -27.966 -12.392 1.00 7.96 C ATOM 2941 CG LEU A 189 6.475 -28.191 -11.319 1.00 8.35 C ATOM 2942 CD1 LEU A 189 7.446 -29.290 -11.749 1.00 8.85 C ATOM 2943 CD2 LEU A 189 7.257 -26.905 -11.028 1.00 8.99 C ATOM 0 H LEU A 189 3.188 -29.394 -11.513 1.00 6.77 H new ATOM 0 HA LEU A 189 4.129 -26.592 -11.257 1.00 7.51 H new ATOM 0 HB2 LEU A 189 5.221 -28.902 -12.930 1.00 7.96 H new ATOM 0 HB3 LEU A 189 5.739 -27.239 -13.115 1.00 7.96 H new ATOM 0 HG LEU A 189 5.966 -28.500 -10.406 1.00 8.35 H new ATOM 0 HD11 LEU A 189 8.207 -29.425 -10.980 1.00 8.85 H new ATOM 0 HD12 LEU A 189 6.901 -30.224 -11.888 1.00 8.85 H new ATOM 0 HD13 LEU A 189 7.924 -29.007 -12.687 1.00 8.85 H new ATOM 0 HD21 LEU A 189 8.018 -27.105 -10.274 1.00 8.99 H new ATOM 0 HD22 LEU A 189 7.735 -26.555 -11.943 1.00 8.99 H new ATOM 0 HD23 LEU A 189 6.574 -26.139 -10.660 1.00 8.99 H new ATOM 2955 N GLU A 190 2.644 -25.829 -13.076 1.00 8.45 N ATOM 2956 CA GLU A 190 1.781 -25.304 -14.147 1.00 9.15 C ATOM 2957 C GLU A 190 2.136 -23.840 -14.461 1.00 10.12 C ATOM 2958 O GLU A 190 2.731 -23.594 -15.532 1.00 10.56 O ATOM 2959 CB GLU A 190 0.291 -25.429 -13.744 1.00 9.15 C ATOM 2960 CG GLU A 190 -0.711 -25.272 -14.901 1.00 8.88 C ATOM 2961 CD GLU A 190 -2.153 -25.329 -14.429 1.00 9.20 C ATOM 2962 OE1 GLU A 190 -2.694 -24.271 -14.046 1.00 9.58 O ATOM 2963 OE2 GLU A 190 -2.739 -26.432 -14.441 1.00 9.27 O ATOM 2964 OXT GLU A 190 1.820 -22.962 -13.631 1.00 10.60 O ATOM 0 H GLU A 190 2.863 -25.148 -12.349 1.00 8.45 H new ATOM 0 HA GLU A 190 1.948 -25.895 -15.048 1.00 9.15 H new ATOM 0 HB2 GLU A 190 0.136 -26.403 -13.279 1.00 9.15 H new ATOM 0 HB3 GLU A 190 0.070 -24.676 -12.988 1.00 9.15 H new ATOM 0 HG2 GLU A 190 -0.534 -24.322 -15.405 1.00 8.88 H new ATOM 0 HG3 GLU A 190 -0.540 -26.059 -15.635 1.00 8.88 H new TER 2971 GLU A 190 HETATM 2972 C1 GLC A 191 -20.008 6.403 2.990 1.00 1.34 C HETATM 2973 C2 GLC A 191 -18.576 5.875 2.574 1.00 1.55 C HETATM 2974 C3 GLC A 191 -18.617 4.295 2.350 1.00 1.62 C HETATM 2975 C4 GLC A 191 -19.316 3.513 3.554 1.00 1.59 C HETATM 2976 C5 GLC A 191 -20.749 4.141 3.847 1.00 1.39 C HETATM 2977 C6 GLC A 191 -21.468 3.595 5.116 1.00 1.49 C HETATM 2978 O2 GLC A 191 -18.196 6.469 1.333 1.00 1.64 O HETATM 2979 O3 GLC A 191 -17.278 3.823 2.212 1.00 1.88 O HETATM 2980 O4 GLC A 191 -19.430 2.125 3.218 1.00 1.73 O HETATM 2981 O5 GLC A 191 -20.489 5.581 4.127 1.00 1.36 O HETATM 2982 O6 GLC A 191 -22.174 4.560 5.887 1.00 1.50 O HETATM 0 HO6 GLC A 191 -21.829 5.455 5.686 1.00 1.50 H new HETATM 0 HO4 GLC A 191 -19.857 1.644 3.957 1.00 1.73 H new HETATM 0 HO3 GLC A 191 -17.286 2.853 2.075 1.00 1.88 H new HETATM 0 HO2 GLC A 191 -17.618 7.242 1.504 1.00 1.64 H new HETATM 0 H62 GLC A 191 -22.169 2.819 4.809 1.00 1.49 H new HETATM 0 H61 GLC A 191 -20.725 3.118 5.756 1.00 1.49 H new HETATM 0 H5 GLC A 191 -21.388 3.910 2.994 1.00 1.39 H new HETATM 0 H4 GLC A 191 -18.709 3.608 4.455 1.00 1.59 H new HETATM 0 H3 GLC A 191 -19.208 4.105 1.454 1.00 1.62 H new HETATM 0 H2 GLC A 191 -17.871 6.129 3.366 1.00 1.55 H new HETATM 2994 C2 BGC A 192 -22.642 9.480 0.190 1.00 1.56 C HETATM 2995 C3 BGC A 192 -21.565 8.352 0.478 1.00 1.44 C HETATM 2996 C4 BGC A 192 -21.921 7.459 1.764 1.00 1.26 C HETATM 2997 C5 BGC A 192 -23.411 6.889 1.604 1.00 1.30 C HETATM 2998 C6 BGC A 192 -23.965 6.140 2.854 1.00 1.26 C HETATM 2999 C1 BGC A 192 -24.066 8.841 0.203 1.00 1.63 C HETATM 3000 O1 BGC A 192 -25.059 9.813 0.145 1.00 1.86 O HETATM 3001 O2 BGC A 192 -22.396 10.083 -1.081 1.00 1.78 O HETATM 3002 O3 BGC A 192 -20.300 8.975 0.685 1.00 1.54 O HETATM 3003 O4 BGC A 192 -20.945 6.350 1.890 1.00 1.27 O HETATM 3004 O5 BGC A 192 -24.282 8.089 1.455 1.00 1.47 O HETATM 3005 O6 BGC A 192 -25.322 6.409 3.186 1.00 1.46 O HETATM 0 H6C2 BGC A 192 -23.857 5.068 2.689 1.00 1.26 H new HETATM 0 H6C1 BGC A 192 -23.343 6.395 3.712 1.00 1.26 H new HETATM 0 HC BGC A 192 -19.627 8.291 0.884 1.00 1.54 H new HETATM 0 HB BGC A 192 -23.067 10.777 -1.249 1.00 1.78 H new HETATM 0 HA BGC A 192 -25.939 9.382 0.154 1.00 1.86 H new HETATM 0 H6 BGC A 192 -25.644 7.169 2.657 1.00 1.46 H new HETATM 0 H5 BGC A 192 -23.400 6.184 0.773 1.00 1.30 H new HETATM 0 H4 BGC A 192 -21.866 8.066 2.668 1.00 1.26 H new HETATM 0 H3 BGC A 192 -21.550 7.685 -0.384 1.00 1.44 H new HETATM 0 H2 BGC A 192 -22.575 10.248 0.960 1.00 1.56 H new HETATM 0 H1 BGC A 192 -24.123 8.188 -0.668 1.00 1.63 H new