USER MOD reduce.3.24.130724 H: found=0, std=0, add=928, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 923 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 65 HIS : no HE2:sc= -5.82! C(o=-8.2!,f=-10!) USER MOD Set 1.2: A 77 MET CE :methyl -158:sc= -2.37 (180deg=-2.06!) USER MOD Set 2.1: A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 57 LYS NZ :NH3+ -134:sc= 1.11 (180deg=0) USER MOD Set 2.3: A 99 TYR OH : rot 180:sc= 1.1 USER MOD Single : A 1 GLY N :NH3+ -132:sc= 0.116 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 18 THR OG1 : rot 175:sc= 0 USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 CYS SG : rot 180:sc= 0.00118 USER MOD Single : A 36 GLN : amide:sc= -0.0253 X(o=-0.025,f=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 GLN : amide:sc= -1.64 K(o=-1.6,f=-2.5!) USER MOD Single : A 43 HIS : no HD1:sc= 0 X(o=0,f=-0.0065) USER MOD Single : A 44 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0397) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 ASN : amide:sc= -3.12! C(o=-3.1!,f=-3.9!) USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : A 59 SER OG : rot 180:sc=-0.00787 USER MOD Single : A 61 THR OG1 : rot -83:sc= 0.51 USER MOD Single : A 62 SER OG : rot -53:sc= 0.19 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 HIS : no HD1:sc= -0.0924 X(o=-0.092,f=-0.29) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 SER OG : rot 180:sc= -0.587 USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 CYS SG : rot -60:sc= -2.74 USER MOD Single : A 82 SER OG : rot 100:sc= 0.978 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 GLN : amide:sc= -1.32 K(o=-1.3,f=0) USER MOD Single : A 98 CYS SG : rot 106:sc= 0.218 USER MOD Single : A 102 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 THR OG1 : rot -7:sc= 0.991 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 9.953 -5.251 21.600 1.00 0.00 N ATOM 2 CA GLY A 1 9.518 -4.377 22.677 1.00 0.00 C ATOM 3 C GLY A 1 8.024 -4.556 22.958 1.00 0.00 C ATOM 4 O GLY A 1 7.377 -5.419 22.367 1.00 0.00 O ATOM 0 H1 GLY A 1 10.821 -5.748 21.885 1.00 0.00 H new ATOM 0 H2 GLY A 1 9.207 -5.946 21.395 1.00 0.00 H new ATOM 0 H3 GLY A 1 10.142 -4.685 20.748 1.00 0.00 H new ATOM 0 HA2 GLY A 1 10.090 -4.593 23.579 1.00 0.00 H new ATOM 0 HA3 GLY A 1 9.720 -3.339 22.412 1.00 0.00 H new ATOM 8 N SER A 2 7.521 -3.727 23.861 1.00 0.00 N ATOM 9 CA SER A 2 6.116 -3.783 24.228 1.00 0.00 C ATOM 10 C SER A 2 5.715 -2.500 24.957 1.00 0.00 C ATOM 11 O SER A 2 4.814 -1.787 24.517 1.00 0.00 O ATOM 12 CB SER A 2 5.824 -5.004 25.102 1.00 0.00 C ATOM 13 OG SER A 2 4.539 -5.558 24.832 1.00 0.00 O ATOM 0 H SER A 2 8.061 -3.013 24.349 1.00 0.00 H new ATOM 0 HA SER A 2 5.527 -3.874 23.316 1.00 0.00 H new ATOM 0 HB2 SER A 2 6.589 -5.762 24.933 1.00 0.00 H new ATOM 0 HB3 SER A 2 5.883 -4.720 26.153 1.00 0.00 H new ATOM 0 HG SER A 2 4.391 -6.336 25.409 1.00 0.00 H new ATOM 19 N SER A 3 6.403 -2.244 26.060 1.00 0.00 N ATOM 20 CA SER A 3 6.129 -1.059 26.855 1.00 0.00 C ATOM 21 C SER A 3 6.317 0.198 26.003 1.00 0.00 C ATOM 22 O SER A 3 7.263 0.287 25.221 1.00 0.00 O ATOM 23 CB SER A 3 7.031 -1.003 28.089 1.00 0.00 C ATOM 24 OG SER A 3 6.280 -1.001 29.300 1.00 0.00 O ATOM 0 H SER A 3 7.150 -2.837 26.422 1.00 0.00 H new ATOM 0 HA SER A 3 5.095 -1.108 27.196 1.00 0.00 H new ATOM 0 HB2 SER A 3 7.707 -1.858 28.083 1.00 0.00 H new ATOM 0 HB3 SER A 3 7.650 -0.107 28.045 1.00 0.00 H new ATOM 0 HG SER A 3 6.892 -0.966 30.064 1.00 0.00 H new ATOM 30 N GLY A 4 5.400 1.138 26.182 1.00 0.00 N ATOM 31 CA GLY A 4 5.453 2.386 25.439 1.00 0.00 C ATOM 32 C GLY A 4 4.062 2.790 24.947 1.00 0.00 C ATOM 33 O GLY A 4 3.572 2.257 23.953 1.00 0.00 O ATOM 0 H GLY A 4 4.616 1.060 26.830 1.00 0.00 H new ATOM 0 HA2 GLY A 4 5.862 3.173 26.072 1.00 0.00 H new ATOM 0 HA3 GLY A 4 6.127 2.279 24.589 1.00 0.00 H new ATOM 37 N SER A 5 3.465 3.730 25.666 1.00 0.00 N ATOM 38 CA SER A 5 2.140 4.212 25.315 1.00 0.00 C ATOM 39 C SER A 5 2.038 5.713 25.594 1.00 0.00 C ATOM 40 O SER A 5 2.160 6.144 26.740 1.00 0.00 O ATOM 41 CB SER A 5 1.057 3.454 26.084 1.00 0.00 C ATOM 42 OG SER A 5 -0.012 3.044 25.236 1.00 0.00 O ATOM 0 H SER A 5 3.875 4.170 26.490 1.00 0.00 H new ATOM 0 HA SER A 5 1.983 4.036 24.251 1.00 0.00 H new ATOM 0 HB2 SER A 5 1.497 2.579 26.562 1.00 0.00 H new ATOM 0 HB3 SER A 5 0.666 4.088 26.879 1.00 0.00 H new ATOM 0 HG SER A 5 -0.682 2.562 25.764 1.00 0.00 H new ATOM 48 N SER A 6 1.816 6.467 24.528 1.00 0.00 N ATOM 49 CA SER A 6 1.697 7.911 24.645 1.00 0.00 C ATOM 50 C SER A 6 1.359 8.519 23.282 1.00 0.00 C ATOM 51 O SER A 6 0.342 9.197 23.136 1.00 0.00 O ATOM 52 CB SER A 6 2.984 8.527 25.196 1.00 0.00 C ATOM 53 OG SER A 6 2.740 9.759 25.870 1.00 0.00 O ATOM 0 H SER A 6 1.715 6.106 23.579 1.00 0.00 H new ATOM 0 HA SER A 6 0.892 8.133 25.345 1.00 0.00 H new ATOM 0 HB2 SER A 6 3.457 7.825 25.883 1.00 0.00 H new ATOM 0 HB3 SER A 6 3.685 8.694 24.378 1.00 0.00 H new ATOM 0 HG SER A 6 3.586 10.120 26.209 1.00 0.00 H new ATOM 59 N GLY A 7 2.230 8.256 22.319 1.00 0.00 N ATOM 60 CA GLY A 7 2.036 8.769 20.974 1.00 0.00 C ATOM 61 C GLY A 7 0.577 8.621 20.535 1.00 0.00 C ATOM 62 O GLY A 7 -0.110 7.693 20.958 1.00 0.00 O ATOM 0 H GLY A 7 3.072 7.694 22.444 1.00 0.00 H new ATOM 0 HA2 GLY A 7 2.326 9.819 20.936 1.00 0.00 H new ATOM 0 HA3 GLY A 7 2.684 8.234 20.280 1.00 0.00 H new ATOM 66 N TYR A 8 0.149 9.550 19.694 1.00 0.00 N ATOM 67 CA TYR A 8 -1.215 9.535 19.194 1.00 0.00 C ATOM 68 C TYR A 8 -1.273 8.959 17.777 1.00 0.00 C ATOM 69 O TYR A 8 -0.287 9.004 17.044 1.00 0.00 O ATOM 70 CB TYR A 8 -1.667 10.997 19.156 1.00 0.00 C ATOM 71 CG TYR A 8 -0.841 11.879 18.217 1.00 0.00 C ATOM 72 CD1 TYR A 8 -1.140 11.921 16.870 1.00 0.00 C ATOM 73 CD2 TYR A 8 0.201 12.632 18.716 1.00 0.00 C ATOM 74 CE1 TYR A 8 -0.363 12.751 15.986 1.00 0.00 C ATOM 75 CE2 TYR A 8 0.978 13.462 17.833 1.00 0.00 C ATOM 76 CZ TYR A 8 0.657 13.481 16.511 1.00 0.00 C ATOM 77 OH TYR A 8 1.391 14.265 15.676 1.00 0.00 O ATOM 0 H TYR A 8 0.723 10.318 19.346 1.00 0.00 H new ATOM 0 HA TYR A 8 -1.850 8.918 19.830 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -2.712 11.036 18.849 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -1.616 11.409 20.164 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -1.956 11.332 16.479 1.00 0.00 H new ATOM 0 HD2 TYR A 8 0.434 12.599 19.770 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -0.585 12.793 14.930 1.00 0.00 H new ATOM 0 HE2 TYR A 8 1.797 14.056 18.211 1.00 0.00 H new ATOM 0 HH TYR A 8 2.085 14.730 16.189 1.00 0.00 H new ATOM 87 N PRO A 9 -2.470 8.417 17.426 1.00 0.00 N ATOM 88 CA PRO A 9 -2.670 7.833 16.111 1.00 0.00 C ATOM 89 C PRO A 9 -2.810 8.920 15.043 1.00 0.00 C ATOM 90 O PRO A 9 -3.623 9.832 15.184 1.00 0.00 O ATOM 91 CB PRO A 9 -3.915 6.972 16.248 1.00 0.00 C ATOM 92 CG PRO A 9 -4.629 7.467 17.495 1.00 0.00 C ATOM 93 CD PRO A 9 -3.661 8.347 18.269 1.00 0.00 C ATOM 0 HA PRO A 9 -1.821 7.233 15.784 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -4.553 7.066 15.369 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -3.653 5.918 16.341 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -5.523 8.029 17.225 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -4.954 6.626 18.108 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -4.080 9.338 18.445 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -3.431 7.920 19.245 1.00 0.00 H new ATOM 101 N ILE A 10 -2.004 8.787 14.000 1.00 0.00 N ATOM 102 CA ILE A 10 -2.027 9.747 12.910 1.00 0.00 C ATOM 103 C ILE A 10 -3.345 9.609 12.143 1.00 0.00 C ATOM 104 O ILE A 10 -3.961 10.609 11.777 1.00 0.00 O ATOM 105 CB ILE A 10 -0.785 9.589 12.030 1.00 0.00 C ATOM 106 CG1 ILE A 10 0.493 9.799 12.845 1.00 0.00 C ATOM 107 CG2 ILE A 10 -0.851 10.519 10.817 1.00 0.00 C ATOM 108 CD1 ILE A 10 1.718 9.288 12.084 1.00 0.00 C ATOM 0 H ILE A 10 -1.331 8.029 13.887 1.00 0.00 H new ATOM 0 HA ILE A 10 -1.987 10.765 13.298 1.00 0.00 H new ATOM 0 HB ILE A 10 -0.761 8.567 11.651 1.00 0.00 H new ATOM 0 HG12 ILE A 10 0.616 10.859 13.069 1.00 0.00 H new ATOM 0 HG13 ILE A 10 0.410 9.279 13.799 1.00 0.00 H new ATOM 0 HG21 ILE A 10 0.043 10.387 10.208 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -1.733 10.280 10.223 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -0.911 11.554 11.155 1.00 0.00 H new ATOM 0 HD11 ILE A 10 2.613 9.449 12.685 1.00 0.00 H new ATOM 0 HD12 ILE A 10 1.603 8.223 11.883 1.00 0.00 H new ATOM 0 HD13 ILE A 10 1.812 9.827 11.142 1.00 0.00 H new ATOM 120 N GLY A 11 -3.737 8.363 11.924 1.00 0.00 N ATOM 121 CA GLY A 11 -4.970 8.082 11.208 1.00 0.00 C ATOM 122 C GLY A 11 -5.174 6.575 11.038 1.00 0.00 C ATOM 123 O GLY A 11 -4.211 5.832 10.852 1.00 0.00 O ATOM 0 H GLY A 11 -3.223 7.537 12.229 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -5.814 8.508 11.750 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -4.944 8.562 10.230 1.00 0.00 H new ATOM 127 N GLU A 12 -6.433 6.169 11.108 1.00 0.00 N ATOM 128 CA GLU A 12 -6.775 4.764 10.964 1.00 0.00 C ATOM 129 C GLU A 12 -7.290 4.485 9.551 1.00 0.00 C ATOM 130 O GLU A 12 -7.631 5.411 8.816 1.00 0.00 O ATOM 131 CB GLU A 12 -7.803 4.340 12.016 1.00 0.00 C ATOM 132 CG GLU A 12 -7.896 2.816 12.107 1.00 0.00 C ATOM 133 CD GLU A 12 -9.069 2.287 11.279 1.00 0.00 C ATOM 134 OE1 GLU A 12 -10.145 2.920 11.350 1.00 0.00 O ATOM 135 OE2 GLU A 12 -8.864 1.263 10.593 1.00 0.00 O ATOM 0 H GLU A 12 -7.229 6.788 11.263 1.00 0.00 H new ATOM 0 HA GLU A 12 -5.874 4.172 11.124 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -7.525 4.750 12.987 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -8.779 4.753 11.763 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -6.966 2.370 11.754 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -8.017 2.517 13.148 1.00 0.00 H new ATOM 142 N ALA A 13 -7.330 3.205 9.212 1.00 0.00 N ATOM 143 CA ALA A 13 -7.798 2.793 7.900 1.00 0.00 C ATOM 144 C ALA A 13 -8.237 1.328 7.956 1.00 0.00 C ATOM 145 O ALA A 13 -7.535 0.487 8.515 1.00 0.00 O ATOM 146 CB ALA A 13 -6.695 3.031 6.867 1.00 0.00 C ATOM 0 H ALA A 13 -7.046 2.440 9.823 1.00 0.00 H new ATOM 0 HA ALA A 13 -8.662 3.385 7.598 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -7.046 2.722 5.882 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -6.439 4.090 6.845 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -5.813 2.450 7.136 1.00 0.00 H new ATOM 152 N SER A 14 -9.397 1.068 7.371 1.00 0.00 N ATOM 153 CA SER A 14 -9.938 -0.280 7.348 1.00 0.00 C ATOM 154 C SER A 14 -9.681 -0.924 5.984 1.00 0.00 C ATOM 155 O SER A 14 -9.625 -0.233 4.968 1.00 0.00 O ATOM 156 CB SER A 14 -11.436 -0.278 7.660 1.00 0.00 C ATOM 157 OG SER A 14 -11.728 0.416 8.870 1.00 0.00 O ATOM 0 H SER A 14 -9.977 1.768 6.909 1.00 0.00 H new ATOM 0 HA SER A 14 -9.435 -0.863 8.119 1.00 0.00 H new ATOM 0 HB2 SER A 14 -11.977 0.187 6.836 1.00 0.00 H new ATOM 0 HB3 SER A 14 -11.792 -1.305 7.736 1.00 0.00 H new ATOM 0 HG SER A 14 -12.694 0.396 9.033 1.00 0.00 H new ATOM 163 N ILE A 15 -9.532 -2.240 6.005 1.00 0.00 N ATOM 164 CA ILE A 15 -9.282 -2.985 4.782 1.00 0.00 C ATOM 165 C ILE A 15 -10.615 -3.450 4.193 1.00 0.00 C ATOM 166 O ILE A 15 -11.356 -4.192 4.835 1.00 0.00 O ATOM 167 CB ILE A 15 -8.293 -4.123 5.041 1.00 0.00 C ATOM 168 CG1 ILE A 15 -6.869 -3.587 5.199 1.00 0.00 C ATOM 169 CG2 ILE A 15 -8.386 -5.189 3.947 1.00 0.00 C ATOM 170 CD1 ILE A 15 -5.917 -4.688 5.672 1.00 0.00 C ATOM 0 H ILE A 15 -9.580 -2.810 6.849 1.00 0.00 H new ATOM 0 HA ILE A 15 -8.809 -2.347 4.036 1.00 0.00 H new ATOM 0 HB ILE A 15 -8.563 -4.602 5.982 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -6.521 -3.184 4.248 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -6.864 -2.765 5.914 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -7.673 -5.987 4.155 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -9.395 -5.601 3.925 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -8.157 -4.740 2.981 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -4.912 -4.280 5.776 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -6.254 -5.072 6.635 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -5.906 -5.498 4.942 1.00 0.00 H new ATOM 182 N LEU A 16 -10.879 -2.995 2.977 1.00 0.00 N ATOM 183 CA LEU A 16 -12.109 -3.355 2.293 1.00 0.00 C ATOM 184 C LEU A 16 -11.872 -4.612 1.453 1.00 0.00 C ATOM 185 O LEU A 16 -12.753 -5.461 1.337 1.00 0.00 O ATOM 186 CB LEU A 16 -12.642 -2.169 1.488 1.00 0.00 C ATOM 187 CG LEU A 16 -12.522 -0.797 2.156 1.00 0.00 C ATOM 188 CD1 LEU A 16 -12.955 0.317 1.201 1.00 0.00 C ATOM 189 CD2 LEU A 16 -13.301 -0.758 3.472 1.00 0.00 C ATOM 0 H LEU A 16 -10.261 -2.380 2.448 1.00 0.00 H new ATOM 0 HA LEU A 16 -12.889 -3.596 3.015 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -12.113 -2.135 0.535 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -13.693 -2.351 1.263 1.00 0.00 H new ATOM 0 HG LEU A 16 -11.473 -0.625 2.397 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -12.860 1.281 1.700 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -12.321 0.303 0.315 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -13.993 0.161 0.907 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -13.199 0.228 3.926 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -14.354 -0.961 3.278 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -12.906 -1.513 4.151 1.00 0.00 H new ATOM 201 N ALA A 17 -10.675 -4.689 0.888 1.00 0.00 N ATOM 202 CA ALA A 17 -10.311 -5.828 0.062 1.00 0.00 C ATOM 203 C ALA A 17 -8.801 -6.059 0.158 1.00 0.00 C ATOM 204 O ALA A 17 -8.061 -5.178 0.591 1.00 0.00 O ATOM 205 CB ALA A 17 -10.773 -5.584 -1.376 1.00 0.00 C ATOM 0 H ALA A 17 -9.946 -3.982 0.986 1.00 0.00 H new ATOM 0 HA ALA A 17 -10.807 -6.733 0.415 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -10.500 -6.438 -1.996 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -11.855 -5.454 -1.393 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -10.293 -4.686 -1.765 1.00 0.00 H new ATOM 211 N THR A 18 -8.390 -7.250 -0.253 1.00 0.00 N ATOM 212 CA THR A 18 -6.983 -7.609 -0.219 1.00 0.00 C ATOM 213 C THR A 18 -6.616 -8.449 -1.444 1.00 0.00 C ATOM 214 O THR A 18 -7.377 -9.327 -1.849 1.00 0.00 O ATOM 215 CB THR A 18 -6.708 -8.318 1.109 1.00 0.00 C ATOM 216 OG1 THR A 18 -7.302 -9.603 0.945 1.00 0.00 O ATOM 217 CG2 THR A 18 -7.479 -7.697 2.275 1.00 0.00 C ATOM 0 H THR A 18 -9.007 -7.979 -0.611 1.00 0.00 H new ATOM 0 HA THR A 18 -6.348 -6.724 -0.270 1.00 0.00 H new ATOM 0 HB THR A 18 -5.640 -8.287 1.323 1.00 0.00 H new ATOM 0 HG1 THR A 18 -7.101 -10.159 1.727 1.00 0.00 H new ATOM 0 HG21 THR A 18 -7.248 -8.237 3.193 1.00 0.00 H new ATOM 0 HG22 THR A 18 -7.190 -6.652 2.387 1.00 0.00 H new ATOM 0 HG23 THR A 18 -8.549 -7.758 2.077 1.00 0.00 H new ATOM 225 N PHE A 19 -5.452 -8.149 -2.000 1.00 0.00 N ATOM 226 CA PHE A 19 -4.975 -8.866 -3.171 1.00 0.00 C ATOM 227 C PHE A 19 -3.449 -8.807 -3.266 1.00 0.00 C ATOM 228 O PHE A 19 -2.791 -8.240 -2.396 1.00 0.00 O ATOM 229 CB PHE A 19 -5.578 -8.173 -4.395 1.00 0.00 C ATOM 230 CG PHE A 19 -5.222 -6.690 -4.509 1.00 0.00 C ATOM 231 CD1 PHE A 19 -3.944 -6.316 -4.786 1.00 0.00 C ATOM 232 CD2 PHE A 19 -6.184 -5.744 -4.334 1.00 0.00 C ATOM 233 CE1 PHE A 19 -3.613 -4.940 -4.892 1.00 0.00 C ATOM 234 CE2 PHE A 19 -5.853 -4.367 -4.440 1.00 0.00 C ATOM 235 CZ PHE A 19 -4.575 -3.994 -4.717 1.00 0.00 C ATOM 0 H PHE A 19 -4.825 -7.419 -1.662 1.00 0.00 H new ATOM 0 HA PHE A 19 -5.268 -9.914 -3.111 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -5.240 -8.687 -5.294 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -6.663 -8.274 -4.359 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -3.180 -7.067 -4.925 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -7.199 -6.040 -4.115 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -2.598 -4.644 -5.112 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -6.616 -3.616 -4.301 1.00 0.00 H new ATOM 0 HZ PHE A 19 -4.324 -2.947 -4.798 1.00 0.00 H new ATOM 245 N THR A 20 -2.932 -9.400 -4.332 1.00 0.00 N ATOM 246 CA THR A 20 -1.496 -9.422 -4.553 1.00 0.00 C ATOM 247 C THR A 20 -1.143 -8.676 -5.841 1.00 0.00 C ATOM 248 O THR A 20 -2.017 -8.396 -6.660 1.00 0.00 O ATOM 249 CB THR A 20 -1.040 -10.882 -4.551 1.00 0.00 C ATOM 250 OG1 THR A 20 -1.801 -11.483 -3.507 1.00 0.00 O ATOM 251 CG2 THR A 20 0.412 -11.042 -4.094 1.00 0.00 C ATOM 0 H THR A 20 -3.482 -9.869 -5.052 1.00 0.00 H new ATOM 0 HA THR A 20 -0.965 -8.900 -3.757 1.00 0.00 H new ATOM 0 HB THR A 20 -1.153 -11.298 -5.552 1.00 0.00 H new ATOM 0 HG1 THR A 20 -1.569 -12.433 -3.438 1.00 0.00 H new ATOM 0 HG21 THR A 20 0.685 -12.097 -4.111 1.00 0.00 H new ATOM 0 HG22 THR A 20 1.068 -10.487 -4.765 1.00 0.00 H new ATOM 0 HG23 THR A 20 0.519 -10.656 -3.080 1.00 0.00 H new ATOM 259 N VAL A 21 0.140 -8.377 -5.981 1.00 0.00 N ATOM 260 CA VAL A 21 0.620 -7.669 -7.156 1.00 0.00 C ATOM 261 C VAL A 21 1.912 -8.324 -7.649 1.00 0.00 C ATOM 262 O VAL A 21 2.593 -9.011 -6.888 1.00 0.00 O ATOM 263 CB VAL A 21 0.787 -6.182 -6.840 1.00 0.00 C ATOM 264 CG1 VAL A 21 -0.572 -5.486 -6.744 1.00 0.00 C ATOM 265 CG2 VAL A 21 1.596 -5.982 -5.557 1.00 0.00 C ATOM 0 H VAL A 21 0.862 -8.612 -5.300 1.00 0.00 H new ATOM 0 HA VAL A 21 -0.108 -7.736 -7.965 1.00 0.00 H new ATOM 0 HB VAL A 21 1.341 -5.725 -7.660 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -0.425 -4.430 -6.518 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -1.099 -5.584 -7.693 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -1.162 -5.947 -5.952 1.00 0.00 H new ATOM 0 HG21 VAL A 21 1.700 -4.916 -5.355 1.00 0.00 H new ATOM 0 HG22 VAL A 21 1.081 -6.461 -4.724 1.00 0.00 H new ATOM 0 HG23 VAL A 21 2.584 -6.427 -5.677 1.00 0.00 H new ATOM 275 N THR A 22 2.210 -8.089 -8.918 1.00 0.00 N ATOM 276 CA THR A 22 3.409 -8.648 -9.521 1.00 0.00 C ATOM 277 C THR A 22 4.363 -7.530 -9.945 1.00 0.00 C ATOM 278 O THR A 22 3.935 -6.522 -10.504 1.00 0.00 O ATOM 279 CB THR A 22 2.979 -9.551 -10.678 1.00 0.00 C ATOM 280 OG1 THR A 22 1.957 -10.371 -10.118 1.00 0.00 O ATOM 281 CG2 THR A 22 4.071 -10.543 -11.084 1.00 0.00 C ATOM 0 H THR A 22 1.643 -7.519 -9.546 1.00 0.00 H new ATOM 0 HA THR A 22 3.966 -9.254 -8.806 1.00 0.00 H new ATOM 0 HB THR A 22 2.709 -8.936 -11.537 1.00 0.00 H new ATOM 0 HG1 THR A 22 1.620 -10.987 -10.802 1.00 0.00 H new ATOM 0 HG21 THR A 22 3.714 -11.160 -11.909 1.00 0.00 H new ATOM 0 HG22 THR A 22 4.960 -9.997 -11.398 1.00 0.00 H new ATOM 0 HG23 THR A 22 4.317 -11.180 -10.235 1.00 0.00 H new ATOM 289 N GLU A 23 5.639 -7.746 -9.662 1.00 0.00 N ATOM 290 CA GLU A 23 6.658 -6.769 -10.007 1.00 0.00 C ATOM 291 C GLU A 23 7.933 -7.474 -10.476 1.00 0.00 C ATOM 292 O GLU A 23 8.729 -7.933 -9.658 1.00 0.00 O ATOM 293 CB GLU A 23 6.949 -5.839 -8.827 1.00 0.00 C ATOM 294 CG GLU A 23 5.759 -4.918 -8.549 1.00 0.00 C ATOM 295 CD GLU A 23 6.215 -3.465 -8.400 1.00 0.00 C ATOM 296 OE1 GLU A 23 7.211 -3.254 -7.675 1.00 0.00 O ATOM 297 OE2 GLU A 23 5.556 -2.598 -9.013 1.00 0.00 O ATOM 0 H GLU A 23 5.991 -8.583 -9.198 1.00 0.00 H new ATOM 0 HA GLU A 23 6.282 -6.156 -10.826 1.00 0.00 H new ATOM 0 HB2 GLU A 23 7.171 -6.431 -7.939 1.00 0.00 H new ATOM 0 HB3 GLU A 23 7.835 -5.241 -9.041 1.00 0.00 H new ATOM 0 HG2 GLU A 23 5.037 -4.995 -9.362 1.00 0.00 H new ATOM 0 HG3 GLU A 23 5.251 -5.239 -7.640 1.00 0.00 H new ATOM 304 N GLY A 24 8.086 -7.538 -11.790 1.00 0.00 N ATOM 305 CA GLY A 24 9.250 -8.180 -12.377 1.00 0.00 C ATOM 306 C GLY A 24 9.045 -9.692 -12.488 1.00 0.00 C ATOM 307 O GLY A 24 9.295 -10.281 -13.538 1.00 0.00 O ATOM 0 H GLY A 24 7.424 -7.156 -12.465 1.00 0.00 H new ATOM 0 HA2 GLY A 24 9.441 -7.762 -13.365 1.00 0.00 H new ATOM 0 HA3 GLY A 24 10.130 -7.973 -11.768 1.00 0.00 H new ATOM 311 N LYS A 25 8.592 -10.277 -11.389 1.00 0.00 N ATOM 312 CA LYS A 25 8.351 -11.710 -11.349 1.00 0.00 C ATOM 313 C LYS A 25 7.821 -12.095 -9.966 1.00 0.00 C ATOM 314 O LYS A 25 6.935 -12.940 -9.851 1.00 0.00 O ATOM 315 CB LYS A 25 9.610 -12.477 -11.760 1.00 0.00 C ATOM 316 CG LYS A 25 9.443 -13.977 -11.514 1.00 0.00 C ATOM 317 CD LYS A 25 10.481 -14.488 -10.513 1.00 0.00 C ATOM 318 CE LYS A 25 11.612 -15.231 -11.227 1.00 0.00 C ATOM 319 NZ LYS A 25 11.487 -16.691 -11.015 1.00 0.00 N ATOM 0 H LYS A 25 8.385 -9.785 -10.520 1.00 0.00 H new ATOM 0 HA LYS A 25 7.585 -11.988 -12.073 1.00 0.00 H new ATOM 0 HB2 LYS A 25 9.820 -12.299 -12.815 1.00 0.00 H new ATOM 0 HB3 LYS A 25 10.466 -12.106 -11.197 1.00 0.00 H new ATOM 0 HG2 LYS A 25 8.440 -14.178 -11.137 1.00 0.00 H new ATOM 0 HG3 LYS A 25 9.544 -14.517 -12.455 1.00 0.00 H new ATOM 0 HD2 LYS A 25 10.891 -13.650 -9.949 1.00 0.00 H new ATOM 0 HD3 LYS A 25 10.002 -15.152 -9.794 1.00 0.00 H new ATOM 0 HE2 LYS A 25 11.585 -15.009 -12.294 1.00 0.00 H new ATOM 0 HE3 LYS A 25 12.576 -14.884 -10.854 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 12.262 -17.181 -11.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 11.535 -16.899 -9.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 10.576 -17.020 -11.393 1.00 0.00 H new ATOM 333 N LYS A 26 8.386 -11.457 -8.952 1.00 0.00 N ATOM 334 CA LYS A 26 7.981 -11.722 -7.582 1.00 0.00 C ATOM 335 C LYS A 26 6.504 -11.362 -7.413 1.00 0.00 C ATOM 336 O LYS A 26 5.878 -10.844 -8.336 1.00 0.00 O ATOM 337 CB LYS A 26 8.906 -11.000 -6.601 1.00 0.00 C ATOM 338 CG LYS A 26 9.328 -11.928 -5.460 1.00 0.00 C ATOM 339 CD LYS A 26 9.034 -11.293 -4.099 1.00 0.00 C ATOM 340 CE LYS A 26 10.007 -10.149 -3.807 1.00 0.00 C ATOM 341 NZ LYS A 26 10.624 -10.322 -2.472 1.00 0.00 N ATOM 0 H LYS A 26 9.121 -10.757 -9.052 1.00 0.00 H new ATOM 0 HA LYS A 26 8.079 -12.783 -7.354 1.00 0.00 H new ATOM 0 HB2 LYS A 26 9.790 -10.640 -7.127 1.00 0.00 H new ATOM 0 HB3 LYS A 26 8.399 -10.125 -6.194 1.00 0.00 H new ATOM 0 HG2 LYS A 26 8.799 -12.877 -5.544 1.00 0.00 H new ATOM 0 HG3 LYS A 26 10.393 -12.148 -5.540 1.00 0.00 H new ATOM 0 HD2 LYS A 26 8.011 -10.918 -4.082 1.00 0.00 H new ATOM 0 HD3 LYS A 26 9.110 -12.049 -3.317 1.00 0.00 H new ATOM 0 HE2 LYS A 26 10.783 -10.119 -4.572 1.00 0.00 H new ATOM 0 HE3 LYS A 26 9.480 -9.196 -3.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 11.282 -9.537 -2.289 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 9.881 -10.328 -1.744 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 11.143 -11.223 -2.444 1.00 0.00 H new ATOM 355 N LYS A 27 5.990 -11.651 -6.226 1.00 0.00 N ATOM 356 CA LYS A 27 4.598 -11.365 -5.924 1.00 0.00 C ATOM 357 C LYS A 27 4.510 -10.653 -4.573 1.00 0.00 C ATOM 358 O LYS A 27 4.683 -11.276 -3.526 1.00 0.00 O ATOM 359 CB LYS A 27 3.759 -12.642 -6.002 1.00 0.00 C ATOM 360 CG LYS A 27 4.350 -13.742 -5.118 1.00 0.00 C ATOM 361 CD LYS A 27 3.368 -14.148 -4.018 1.00 0.00 C ATOM 362 CE LYS A 27 2.463 -15.289 -4.485 1.00 0.00 C ATOM 363 NZ LYS A 27 1.453 -15.607 -3.450 1.00 0.00 N ATOM 0 H LYS A 27 6.513 -12.080 -5.462 1.00 0.00 H new ATOM 0 HA LYS A 27 4.178 -10.689 -6.669 1.00 0.00 H new ATOM 0 HB2 LYS A 27 2.737 -12.429 -5.689 1.00 0.00 H new ATOM 0 HB3 LYS A 27 3.711 -12.987 -7.035 1.00 0.00 H new ATOM 0 HG2 LYS A 27 4.597 -14.611 -5.728 1.00 0.00 H new ATOM 0 HG3 LYS A 27 5.280 -13.393 -4.669 1.00 0.00 H new ATOM 0 HD2 LYS A 27 3.919 -14.456 -3.129 1.00 0.00 H new ATOM 0 HD3 LYS A 27 2.760 -13.289 -3.734 1.00 0.00 H new ATOM 0 HE2 LYS A 27 1.965 -15.009 -5.413 1.00 0.00 H new ATOM 0 HE3 LYS A 27 3.064 -16.173 -4.699 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 0.847 -16.384 -3.783 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 1.933 -15.894 -2.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 0.869 -14.767 -3.265 1.00 0.00 H new ATOM 377 N ILE A 28 4.241 -9.357 -4.639 1.00 0.00 N ATOM 378 CA ILE A 28 4.128 -8.554 -3.433 1.00 0.00 C ATOM 379 C ILE A 28 2.652 -8.416 -3.054 1.00 0.00 C ATOM 380 O ILE A 28 1.829 -8.025 -3.879 1.00 0.00 O ATOM 381 CB ILE A 28 4.844 -7.214 -3.613 1.00 0.00 C ATOM 382 CG1 ILE A 28 6.249 -7.416 -4.185 1.00 0.00 C ATOM 383 CG2 ILE A 28 4.866 -6.424 -2.303 1.00 0.00 C ATOM 384 CD1 ILE A 28 6.197 -7.670 -5.692 1.00 0.00 C ATOM 0 H ILE A 28 4.098 -8.843 -5.509 1.00 0.00 H new ATOM 0 HA ILE A 28 4.627 -9.047 -2.599 1.00 0.00 H new ATOM 0 HB ILE A 28 4.284 -6.621 -4.337 1.00 0.00 H new ATOM 0 HG12 ILE A 28 6.858 -6.535 -3.982 1.00 0.00 H new ATOM 0 HG13 ILE A 28 6.730 -8.258 -3.687 1.00 0.00 H new ATOM 0 HG21 ILE A 28 5.381 -5.476 -2.459 1.00 0.00 H new ATOM 0 HG22 ILE A 28 3.844 -6.233 -1.976 1.00 0.00 H new ATOM 0 HG23 ILE A 28 5.389 -7.000 -1.540 1.00 0.00 H new ATOM 0 HD11 ILE A 28 7.209 -7.810 -6.072 1.00 0.00 H new ATOM 0 HD12 ILE A 28 5.608 -8.565 -5.890 1.00 0.00 H new ATOM 0 HD13 ILE A 28 5.737 -6.816 -6.189 1.00 0.00 H new ATOM 396 N PRO A 29 2.355 -8.755 -1.771 1.00 0.00 N ATOM 397 CA PRO A 29 0.993 -8.673 -1.271 1.00 0.00 C ATOM 398 C PRO A 29 0.588 -7.219 -1.018 1.00 0.00 C ATOM 399 O PRO A 29 1.402 -6.413 -0.571 1.00 0.00 O ATOM 400 CB PRO A 29 0.984 -9.520 -0.010 1.00 0.00 C ATOM 401 CG PRO A 29 2.440 -9.664 0.405 1.00 0.00 C ATOM 402 CD PRO A 29 3.304 -9.223 -0.765 1.00 0.00 C ATOM 0 HA PRO A 29 0.260 -9.043 -1.988 1.00 0.00 H new ATOM 0 HB2 PRO A 29 0.399 -9.043 0.777 1.00 0.00 H new ATOM 0 HB3 PRO A 29 0.533 -10.494 -0.197 1.00 0.00 H new ATOM 0 HG2 PRO A 29 2.648 -9.055 1.284 1.00 0.00 H new ATOM 0 HG3 PRO A 29 2.660 -10.697 0.674 1.00 0.00 H new ATOM 0 HD2 PRO A 29 3.993 -8.431 -0.472 1.00 0.00 H new ATOM 0 HD3 PRO A 29 3.908 -10.047 -1.144 1.00 0.00 H new ATOM 410 N VAL A 30 -0.670 -6.929 -1.316 1.00 0.00 N ATOM 411 CA VAL A 30 -1.193 -5.586 -1.126 1.00 0.00 C ATOM 412 C VAL A 30 -2.533 -5.664 -0.392 1.00 0.00 C ATOM 413 O VAL A 30 -3.244 -6.662 -0.496 1.00 0.00 O ATOM 414 CB VAL A 30 -1.290 -4.867 -2.473 1.00 0.00 C ATOM 415 CG1 VAL A 30 -2.073 -3.559 -2.341 1.00 0.00 C ATOM 416 CG2 VAL A 30 0.099 -4.618 -3.063 1.00 0.00 C ATOM 0 H VAL A 30 -1.342 -7.600 -1.687 1.00 0.00 H new ATOM 0 HA VAL A 30 -0.517 -4.997 -0.506 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.834 -5.515 -3.160 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -2.127 -3.068 -3.313 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -3.081 -3.773 -1.986 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -1.569 -2.903 -1.631 1.00 0.00 H new ATOM 0 HG21 VAL A 30 0.001 -4.106 -4.020 1.00 0.00 H new ATOM 0 HG22 VAL A 30 0.680 -4.000 -2.378 1.00 0.00 H new ATOM 0 HG23 VAL A 30 0.607 -5.571 -3.212 1.00 0.00 H new ATOM 426 N ALA A 31 -2.836 -4.598 0.335 1.00 0.00 N ATOM 427 CA ALA A 31 -4.078 -4.534 1.086 1.00 0.00 C ATOM 428 C ALA A 31 -4.755 -3.186 0.828 1.00 0.00 C ATOM 429 O ALA A 31 -4.223 -2.140 1.196 1.00 0.00 O ATOM 430 CB ALA A 31 -3.790 -4.767 2.570 1.00 0.00 C ATOM 0 H ALA A 31 -2.243 -3.772 0.420 1.00 0.00 H new ATOM 0 HA ALA A 31 -4.764 -5.316 0.761 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -4.722 -4.719 3.133 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -3.336 -5.749 2.703 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -3.107 -3.999 2.933 1.00 0.00 H new ATOM 436 N ASP A 32 -5.919 -3.256 0.199 1.00 0.00 N ATOM 437 CA ASP A 32 -6.675 -2.054 -0.112 1.00 0.00 C ATOM 438 C ASP A 32 -7.502 -1.647 1.109 1.00 0.00 C ATOM 439 O ASP A 32 -8.384 -2.387 1.541 1.00 0.00 O ATOM 440 CB ASP A 32 -7.638 -2.295 -1.276 1.00 0.00 C ATOM 441 CG ASP A 32 -7.277 -1.571 -2.574 1.00 0.00 C ATOM 442 OD1 ASP A 32 -6.168 -0.996 -2.614 1.00 0.00 O ATOM 443 OD2 ASP A 32 -8.119 -1.609 -3.498 1.00 0.00 O ATOM 0 H ASP A 32 -6.357 -4.126 -0.104 1.00 0.00 H new ATOM 0 HA ASP A 32 -5.967 -1.272 -0.386 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -7.683 -3.366 -1.475 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -8.638 -1.986 -0.971 1.00 0.00 H new ATOM 448 N CYS A 33 -7.186 -0.471 1.632 1.00 0.00 N ATOM 449 CA CYS A 33 -7.889 0.044 2.795 1.00 0.00 C ATOM 450 C CYS A 33 -8.376 1.459 2.474 1.00 0.00 C ATOM 451 O CYS A 33 -7.704 2.205 1.764 1.00 0.00 O ATOM 452 CB CYS A 33 -7.009 0.014 4.046 1.00 0.00 C ATOM 453 SG CYS A 33 -5.338 0.647 3.653 1.00 0.00 S ATOM 0 H CYS A 33 -6.453 0.140 1.272 1.00 0.00 H new ATOM 0 HA CYS A 33 -8.745 -0.593 3.017 1.00 0.00 H new ATOM 0 HB2 CYS A 33 -7.460 0.619 4.832 1.00 0.00 H new ATOM 0 HB3 CYS A 33 -6.940 -1.005 4.428 1.00 0.00 H new ATOM 0 HG CYS A 33 -4.601 0.619 4.723 1.00 0.00 H new ATOM 459 N ARG A 34 -9.542 1.785 3.014 1.00 0.00 N ATOM 460 CA ARG A 34 -10.127 3.096 2.794 1.00 0.00 C ATOM 461 C ARG A 34 -9.992 3.956 4.053 1.00 0.00 C ATOM 462 O ARG A 34 -10.566 3.635 5.092 1.00 0.00 O ATOM 463 CB ARG A 34 -11.606 2.984 2.418 1.00 0.00 C ATOM 464 CG ARG A 34 -12.220 4.366 2.189 1.00 0.00 C ATOM 465 CD ARG A 34 -12.683 4.527 0.739 1.00 0.00 C ATOM 466 NE ARG A 34 -13.760 5.539 0.661 1.00 0.00 N ATOM 467 CZ ARG A 34 -14.201 6.079 -0.483 1.00 0.00 C ATOM 468 NH1 ARG A 34 -13.662 5.707 -1.652 1.00 0.00 N ATOM 469 NH2 ARG A 34 -15.183 6.991 -0.459 1.00 0.00 N ATOM 0 H ARG A 34 -10.096 1.164 3.603 1.00 0.00 H new ATOM 0 HA ARG A 34 -9.589 3.564 1.970 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -11.711 2.382 1.516 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -12.148 2.468 3.210 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -13.065 4.508 2.862 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -11.488 5.137 2.429 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -11.844 4.828 0.112 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -13.042 3.572 0.355 1.00 0.00 H new ATOM 0 HE ARG A 34 -14.193 5.844 1.532 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -12.915 5.012 -1.671 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -13.998 6.119 -2.523 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -15.595 7.274 0.430 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -15.519 7.402 -1.330 1.00 0.00 H new ATOM 483 N VAL A 35 -9.229 5.031 3.917 1.00 0.00 N ATOM 484 CA VAL A 35 -9.011 5.938 5.031 1.00 0.00 C ATOM 485 C VAL A 35 -10.361 6.436 5.550 1.00 0.00 C ATOM 486 O VAL A 35 -11.113 7.078 4.818 1.00 0.00 O ATOM 487 CB VAL A 35 -8.078 7.074 4.605 1.00 0.00 C ATOM 488 CG1 VAL A 35 -7.854 8.059 5.755 1.00 0.00 C ATOM 489 CG2 VAL A 35 -6.748 6.526 4.085 1.00 0.00 C ATOM 0 H VAL A 35 -8.755 5.294 3.053 1.00 0.00 H new ATOM 0 HA VAL A 35 -8.518 5.421 5.854 1.00 0.00 H new ATOM 0 HB VAL A 35 -8.558 7.614 3.789 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -7.188 8.857 5.426 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -8.809 8.487 6.059 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -7.405 7.536 6.600 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -6.104 7.354 3.789 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -6.260 5.950 4.871 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -6.931 5.883 3.224 1.00 0.00 H new ATOM 499 N GLN A 36 -10.628 6.121 6.809 1.00 0.00 N ATOM 500 CA GLN A 36 -11.875 6.528 7.434 1.00 0.00 C ATOM 501 C GLN A 36 -11.691 7.856 8.171 1.00 0.00 C ATOM 502 O GLN A 36 -12.589 8.696 8.178 1.00 0.00 O ATOM 503 CB GLN A 36 -12.394 5.443 8.380 1.00 0.00 C ATOM 504 CG GLN A 36 -12.801 4.188 7.605 1.00 0.00 C ATOM 505 CD GLN A 36 -14.293 3.898 7.776 1.00 0.00 C ATOM 506 OE1 GLN A 36 -14.784 3.658 8.867 1.00 0.00 O ATOM 507 NE2 GLN A 36 -14.985 3.932 6.641 1.00 0.00 N ATOM 0 H GLN A 36 -10.002 5.589 7.413 1.00 0.00 H new ATOM 0 HA GLN A 36 -12.621 6.669 6.652 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -11.623 5.191 9.108 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -13.249 5.822 8.940 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -12.571 4.319 6.548 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -12.219 3.335 7.955 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -14.512 4.139 5.761 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -15.989 3.751 6.650 1.00 0.00 H new ATOM 516 N LYS A 37 -10.520 8.004 8.773 1.00 0.00 N ATOM 517 CA LYS A 37 -10.206 9.215 9.511 1.00 0.00 C ATOM 518 C LYS A 37 -8.722 9.543 9.338 1.00 0.00 C ATOM 519 O LYS A 37 -7.893 8.641 9.219 1.00 0.00 O ATOM 520 CB LYS A 37 -10.640 9.080 10.972 1.00 0.00 C ATOM 521 CG LYS A 37 -12.165 9.039 11.090 1.00 0.00 C ATOM 522 CD LYS A 37 -12.619 9.474 12.485 1.00 0.00 C ATOM 523 CE LYS A 37 -13.106 8.275 13.301 1.00 0.00 C ATOM 524 NZ LYS A 37 -12.563 8.330 14.677 1.00 0.00 N ATOM 0 H LYS A 37 -9.777 7.305 8.765 1.00 0.00 H new ATOM 0 HA LYS A 37 -10.768 10.060 9.113 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -10.214 8.172 11.399 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -10.249 9.918 11.550 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -12.609 9.692 10.339 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -12.522 8.030 10.886 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -11.794 9.961 13.005 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -13.419 10.209 12.398 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -14.195 8.268 13.334 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -12.796 7.349 12.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -12.903 7.509 15.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -11.524 8.314 14.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -12.880 9.205 15.141 1.00 0.00 H new ATOM 538 N GLY A 38 -8.430 10.835 9.331 1.00 0.00 N ATOM 539 CA GLY A 38 -7.060 11.293 9.174 1.00 0.00 C ATOM 540 C GLY A 38 -6.472 10.817 7.844 1.00 0.00 C ATOM 541 O GLY A 38 -7.185 10.711 6.848 1.00 0.00 O ATOM 0 H GLY A 38 -9.119 11.580 9.432 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -7.029 12.382 9.221 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -6.452 10.921 9.999 1.00 0.00 H new ATOM 545 N GLN A 39 -5.175 10.544 7.872 1.00 0.00 N ATOM 546 CA GLN A 39 -4.483 10.082 6.681 1.00 0.00 C ATOM 547 C GLN A 39 -3.413 9.054 7.054 1.00 0.00 C ATOM 548 O GLN A 39 -3.123 8.855 8.232 1.00 0.00 O ATOM 549 CB GLN A 39 -3.872 11.256 5.912 1.00 0.00 C ATOM 550 CG GLN A 39 -2.785 11.946 6.739 1.00 0.00 C ATOM 551 CD GLN A 39 -2.604 13.401 6.301 1.00 0.00 C ATOM 552 OE1 GLN A 39 -3.504 14.035 5.775 1.00 0.00 O ATOM 553 NE2 GLN A 39 -1.393 13.893 6.546 1.00 0.00 N ATOM 0 H GLN A 39 -4.586 10.634 8.700 1.00 0.00 H new ATOM 0 HA GLN A 39 -5.209 9.600 6.026 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -3.448 10.899 4.973 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -4.652 11.974 5.658 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -3.050 11.911 7.796 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -1.843 11.409 6.628 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -0.685 13.308 6.990 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -1.172 14.855 6.290 1.00 0.00 H new ATOM 562 N LEU A 40 -2.855 8.429 6.027 1.00 0.00 N ATOM 563 CA LEU A 40 -1.823 7.427 6.232 1.00 0.00 C ATOM 564 C LEU A 40 -0.514 7.914 5.610 1.00 0.00 C ATOM 565 O LEU A 40 -0.461 8.210 4.417 1.00 0.00 O ATOM 566 CB LEU A 40 -2.286 6.067 5.706 1.00 0.00 C ATOM 567 CG LEU A 40 -3.710 5.652 6.080 1.00 0.00 C ATOM 568 CD1 LEU A 40 -4.137 4.402 5.309 1.00 0.00 C ATOM 569 CD2 LEU A 40 -3.848 5.467 7.593 1.00 0.00 C ATOM 0 H LEU A 40 -3.098 8.597 5.051 1.00 0.00 H new ATOM 0 HA LEU A 40 -1.636 7.285 7.296 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -2.204 6.073 4.619 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.599 5.305 6.073 1.00 0.00 H new ATOM 0 HG LEU A 40 -4.387 6.456 5.791 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -5.153 4.128 5.594 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -4.102 4.605 4.239 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -3.461 3.580 5.545 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -4.870 5.172 7.832 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -3.159 4.692 7.929 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -3.614 6.405 8.097 1.00 0.00 H new ATOM 581 N GLU A 41 0.512 7.984 6.445 1.00 0.00 N ATOM 582 CA GLU A 41 1.818 8.430 5.992 1.00 0.00 C ATOM 583 C GLU A 41 2.506 7.327 5.186 1.00 0.00 C ATOM 584 O GLU A 41 2.025 6.196 5.138 1.00 0.00 O ATOM 585 CB GLU A 41 2.687 8.871 7.171 1.00 0.00 C ATOM 586 CG GLU A 41 2.880 10.389 7.173 1.00 0.00 C ATOM 587 CD GLU A 41 2.795 10.950 8.594 1.00 0.00 C ATOM 588 OE1 GLU A 41 3.831 10.888 9.292 1.00 0.00 O ATOM 589 OE2 GLU A 41 1.697 11.430 8.950 1.00 0.00 O ATOM 0 H GLU A 41 0.465 7.739 7.434 1.00 0.00 H new ATOM 0 HA GLU A 41 1.679 9.294 5.343 1.00 0.00 H new ATOM 0 HB2 GLU A 41 2.223 8.559 8.106 1.00 0.00 H new ATOM 0 HB3 GLU A 41 3.657 8.378 7.117 1.00 0.00 H new ATOM 0 HG2 GLU A 41 3.848 10.637 6.738 1.00 0.00 H new ATOM 0 HG3 GLU A 41 2.120 10.857 6.547 1.00 0.00 H new ATOM 596 N ARG A 42 3.622 7.693 4.572 1.00 0.00 N ATOM 597 CA ARG A 42 4.381 6.748 3.771 1.00 0.00 C ATOM 598 C ARG A 42 5.713 6.425 4.452 1.00 0.00 C ATOM 599 O ARG A 42 6.509 7.322 4.724 1.00 0.00 O ATOM 600 CB ARG A 42 4.653 7.306 2.373 1.00 0.00 C ATOM 601 CG ARG A 42 5.546 6.359 1.569 1.00 0.00 C ATOM 602 CD ARG A 42 4.762 5.698 0.433 1.00 0.00 C ATOM 603 NE ARG A 42 5.561 5.720 -0.813 1.00 0.00 N ATOM 604 CZ ARG A 42 5.827 6.829 -1.515 1.00 0.00 C ATOM 605 NH1 ARG A 42 5.359 8.014 -1.099 1.00 0.00 N ATOM 606 NH2 ARG A 42 6.560 6.754 -2.634 1.00 0.00 N ATOM 0 H ARG A 42 4.019 8.632 4.613 1.00 0.00 H new ATOM 0 HA ARG A 42 3.787 5.839 3.678 1.00 0.00 H new ATOM 0 HB2 ARG A 42 3.710 7.456 1.848 1.00 0.00 H new ATOM 0 HB3 ARG A 42 5.132 8.282 2.454 1.00 0.00 H new ATOM 0 HG2 ARG A 42 6.391 6.911 1.159 1.00 0.00 H new ATOM 0 HG3 ARG A 42 5.955 5.593 2.227 1.00 0.00 H new ATOM 0 HD2 ARG A 42 4.517 4.670 0.699 1.00 0.00 H new ATOM 0 HD3 ARG A 42 3.818 6.221 0.279 1.00 0.00 H new ATOM 0 HE ARG A 42 5.932 4.835 -1.159 1.00 0.00 H new ATOM 0 HH11 ARG A 42 4.800 8.071 -0.248 1.00 0.00 H new ATOM 0 HH12 ARG A 42 5.562 8.859 -1.634 1.00 0.00 H new ATOM 0 HH21 ARG A 42 6.915 5.852 -2.951 1.00 0.00 H new ATOM 0 HH22 ARG A 42 6.763 7.599 -3.169 1.00 0.00 H new ATOM 620 N HIS A 43 5.913 5.140 4.707 1.00 0.00 N ATOM 621 CA HIS A 43 7.135 4.687 5.351 1.00 0.00 C ATOM 622 C HIS A 43 6.941 4.677 6.869 1.00 0.00 C ATOM 623 O HIS A 43 7.623 3.940 7.580 1.00 0.00 O ATOM 624 CB HIS A 43 8.328 5.537 4.911 1.00 0.00 C ATOM 625 CG HIS A 43 9.639 4.788 4.883 1.00 0.00 C ATOM 626 ND1 HIS A 43 10.262 4.410 3.707 1.00 0.00 N ATOM 627 CD2 HIS A 43 10.437 4.351 5.899 1.00 0.00 C ATOM 628 CE1 HIS A 43 11.384 3.775 4.013 1.00 0.00 C ATOM 629 NE2 HIS A 43 11.490 3.739 5.372 1.00 0.00 N ATOM 0 H HIS A 43 5.250 4.399 4.480 1.00 0.00 H new ATOM 0 HA HIS A 43 7.357 3.666 5.041 1.00 0.00 H new ATOM 0 HB2 HIS A 43 8.129 5.937 3.917 1.00 0.00 H new ATOM 0 HB3 HIS A 43 8.422 6.389 5.585 1.00 0.00 H new ATOM 0 HD2 HIS A 43 10.245 4.481 6.954 1.00 0.00 H new ATOM 0 HE1 HIS A 43 12.090 3.359 3.310 1.00 0.00 H new ATOM 0 HE2 HIS A 43 12.253 3.312 5.897 1.00 0.00 H new ATOM 637 N LYS A 44 6.009 5.503 7.320 1.00 0.00 N ATOM 638 CA LYS A 44 5.718 5.598 8.740 1.00 0.00 C ATOM 639 C LYS A 44 5.511 4.193 9.309 1.00 0.00 C ATOM 640 O LYS A 44 5.588 3.206 8.579 1.00 0.00 O ATOM 641 CB LYS A 44 4.537 6.540 8.983 1.00 0.00 C ATOM 642 CG LYS A 44 5.011 7.987 9.133 1.00 0.00 C ATOM 643 CD LYS A 44 5.716 8.196 10.475 1.00 0.00 C ATOM 644 CE LYS A 44 6.075 9.669 10.682 1.00 0.00 C ATOM 645 NZ LYS A 44 7.081 9.811 11.759 1.00 0.00 N ATOM 0 H LYS A 44 5.446 6.113 6.727 1.00 0.00 H new ATOM 0 HA LYS A 44 6.561 6.037 9.273 1.00 0.00 H new ATOM 0 HB2 LYS A 44 3.833 6.468 8.154 1.00 0.00 H new ATOM 0 HB3 LYS A 44 4.002 6.234 9.882 1.00 0.00 H new ATOM 0 HG2 LYS A 44 5.690 8.237 8.318 1.00 0.00 H new ATOM 0 HG3 LYS A 44 4.159 8.662 9.057 1.00 0.00 H new ATOM 0 HD2 LYS A 44 5.070 7.858 11.286 1.00 0.00 H new ATOM 0 HD3 LYS A 44 6.620 7.589 10.513 1.00 0.00 H new ATOM 0 HE2 LYS A 44 6.465 10.088 9.754 1.00 0.00 H new ATOM 0 HE3 LYS A 44 5.179 10.236 10.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 7.164 10.813 12.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 6.785 9.255 12.586 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 8.002 9.466 11.421 1.00 0.00 H new ATOM 659 N LYS A 45 5.252 4.148 10.608 1.00 0.00 N ATOM 660 CA LYS A 45 5.034 2.880 11.284 1.00 0.00 C ATOM 661 C LYS A 45 3.542 2.540 11.252 1.00 0.00 C ATOM 662 O LYS A 45 2.698 3.423 11.395 1.00 0.00 O ATOM 663 CB LYS A 45 5.627 2.915 12.694 1.00 0.00 C ATOM 664 CG LYS A 45 7.154 2.992 12.645 1.00 0.00 C ATOM 665 CD LYS A 45 7.628 4.445 12.577 1.00 0.00 C ATOM 666 CE LYS A 45 8.946 4.627 13.332 1.00 0.00 C ATOM 667 NZ LYS A 45 9.417 6.026 13.223 1.00 0.00 N ATOM 0 H LYS A 45 5.188 4.969 11.210 1.00 0.00 H new ATOM 0 HA LYS A 45 5.556 2.077 10.764 1.00 0.00 H new ATOM 0 HB2 LYS A 45 5.233 3.774 13.237 1.00 0.00 H new ATOM 0 HB3 LYS A 45 5.322 2.024 13.243 1.00 0.00 H new ATOM 0 HG2 LYS A 45 7.574 2.510 13.527 1.00 0.00 H new ATOM 0 HG3 LYS A 45 7.522 2.445 11.777 1.00 0.00 H new ATOM 0 HD2 LYS A 45 7.757 4.741 11.536 1.00 0.00 H new ATOM 0 HD3 LYS A 45 6.868 5.100 13.002 1.00 0.00 H new ATOM 0 HE2 LYS A 45 8.810 4.363 14.381 1.00 0.00 H new ATOM 0 HE3 LYS A 45 9.700 3.951 12.928 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 10.313 6.132 13.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 9.566 6.265 12.222 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 8.704 6.665 13.629 1.00 0.00 H new ATOM 681 N PHE A 46 3.264 1.259 11.063 1.00 0.00 N ATOM 682 CA PHE A 46 1.889 0.792 11.010 1.00 0.00 C ATOM 683 C PHE A 46 1.772 -0.630 11.563 1.00 0.00 C ATOM 684 O PHE A 46 2.769 -1.229 11.962 1.00 0.00 O ATOM 685 CB PHE A 46 1.473 0.790 9.538 1.00 0.00 C ATOM 686 CG PHE A 46 1.516 2.169 8.877 1.00 0.00 C ATOM 687 CD1 PHE A 46 2.712 2.760 8.613 1.00 0.00 C ATOM 688 CD2 PHE A 46 0.357 2.804 8.554 1.00 0.00 C ATOM 689 CE1 PHE A 46 2.751 4.041 8.000 1.00 0.00 C ATOM 690 CE2 PHE A 46 0.397 4.085 7.941 1.00 0.00 C ATOM 691 CZ PHE A 46 1.593 4.676 7.677 1.00 0.00 C ATOM 0 H PHE A 46 3.967 0.530 10.945 1.00 0.00 H new ATOM 0 HA PHE A 46 1.252 1.441 11.611 1.00 0.00 H new ATOM 0 HB2 PHE A 46 2.127 0.114 8.987 1.00 0.00 H new ATOM 0 HB3 PHE A 46 0.462 0.391 9.457 1.00 0.00 H new ATOM 0 HD1 PHE A 46 3.632 2.256 8.869 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -0.593 2.335 8.763 1.00 0.00 H new ATOM 0 HE1 PHE A 46 3.701 4.511 7.791 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -0.523 4.590 7.685 1.00 0.00 H new ATOM 0 HZ PHE A 46 1.623 5.650 7.211 1.00 0.00 H new ATOM 701 N LYS A 47 0.544 -1.129 11.569 1.00 0.00 N ATOM 702 CA LYS A 47 0.283 -2.469 12.066 1.00 0.00 C ATOM 703 C LYS A 47 -1.081 -2.940 11.559 1.00 0.00 C ATOM 704 O LYS A 47 -1.969 -2.126 11.308 1.00 0.00 O ATOM 705 CB LYS A 47 0.421 -2.512 13.589 1.00 0.00 C ATOM 706 CG LYS A 47 -0.371 -1.378 14.243 1.00 0.00 C ATOM 707 CD LYS A 47 -0.726 -1.723 15.691 1.00 0.00 C ATOM 708 CE LYS A 47 -1.539 -0.599 16.338 1.00 0.00 C ATOM 709 NZ LYS A 47 -1.025 -0.304 17.695 1.00 0.00 N ATOM 0 H LYS A 47 -0.281 -0.629 11.237 1.00 0.00 H new ATOM 0 HA LYS A 47 1.025 -3.169 11.682 1.00 0.00 H new ATOM 0 HB2 LYS A 47 0.065 -3.472 13.963 1.00 0.00 H new ATOM 0 HB3 LYS A 47 1.472 -2.432 13.865 1.00 0.00 H new ATOM 0 HG2 LYS A 47 0.214 -0.459 14.217 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -1.283 -1.192 13.675 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -1.296 -2.652 15.718 1.00 0.00 H new ATOM 0 HD3 LYS A 47 0.186 -1.892 16.263 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -1.488 0.297 15.720 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -2.589 -0.887 16.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -1.587 0.461 18.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -1.097 -1.157 18.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -0.030 -0.009 17.633 1.00 0.00 H new ATOM 723 N LEU A 48 -1.206 -4.252 11.423 1.00 0.00 N ATOM 724 CA LEU A 48 -2.447 -4.841 10.950 1.00 0.00 C ATOM 725 C LEU A 48 -3.194 -5.462 12.132 1.00 0.00 C ATOM 726 O LEU A 48 -2.668 -6.343 12.809 1.00 0.00 O ATOM 727 CB LEU A 48 -2.174 -5.823 9.810 1.00 0.00 C ATOM 728 CG LEU A 48 -3.405 -6.472 9.174 1.00 0.00 C ATOM 729 CD1 LEU A 48 -4.176 -5.464 8.318 1.00 0.00 C ATOM 730 CD2 LEU A 48 -3.019 -7.721 8.379 1.00 0.00 C ATOM 0 H LEU A 48 -0.468 -4.924 11.632 1.00 0.00 H new ATOM 0 HA LEU A 48 -3.097 -4.074 10.529 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -1.621 -5.299 9.031 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -1.524 -6.614 10.186 1.00 0.00 H new ATOM 0 HG LEU A 48 -4.072 -6.793 9.974 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -5.046 -5.951 7.878 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -4.503 -4.632 8.942 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -3.529 -5.090 7.524 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -3.913 -8.162 7.938 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -2.321 -7.447 7.588 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -2.548 -8.445 9.044 1.00 0.00 H new ATOM 742 N ILE A 49 -4.410 -4.979 12.343 1.00 0.00 N ATOM 743 CA ILE A 49 -5.235 -5.476 13.431 1.00 0.00 C ATOM 744 C ILE A 49 -6.412 -6.264 12.854 1.00 0.00 C ATOM 745 O ILE A 49 -7.286 -5.693 12.203 1.00 0.00 O ATOM 746 CB ILE A 49 -5.655 -4.329 14.352 1.00 0.00 C ATOM 747 CG1 ILE A 49 -4.433 -3.646 14.970 1.00 0.00 C ATOM 748 CG2 ILE A 49 -6.640 -4.813 15.417 1.00 0.00 C ATOM 749 CD1 ILE A 49 -3.602 -2.935 13.899 1.00 0.00 C ATOM 0 H ILE A 49 -4.844 -4.248 11.779 1.00 0.00 H new ATOM 0 HA ILE A 49 -4.666 -6.164 14.056 1.00 0.00 H new ATOM 0 HB ILE A 49 -6.172 -3.581 13.751 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -4.756 -2.926 15.722 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -3.818 -4.387 15.481 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -6.922 -3.978 16.058 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -7.530 -5.216 14.933 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -6.171 -5.591 16.020 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -2.740 -2.458 14.365 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -3.260 -3.661 13.162 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -4.213 -2.179 13.407 1.00 0.00 H new ATOM 761 N ARG A 50 -6.397 -7.563 13.112 1.00 0.00 N ATOM 762 CA ARG A 50 -7.452 -8.436 12.626 1.00 0.00 C ATOM 763 C ARG A 50 -8.160 -9.116 13.800 1.00 0.00 C ATOM 764 O ARG A 50 -7.563 -9.931 14.502 1.00 0.00 O ATOM 765 CB ARG A 50 -6.893 -9.506 11.687 1.00 0.00 C ATOM 766 CG ARG A 50 -8.013 -10.392 11.138 1.00 0.00 C ATOM 767 CD ARG A 50 -7.489 -11.788 10.794 1.00 0.00 C ATOM 768 NE ARG A 50 -6.549 -11.709 9.654 1.00 0.00 N ATOM 769 CZ ARG A 50 -5.818 -12.741 9.210 1.00 0.00 C ATOM 770 NH1 ARG A 50 -5.914 -13.936 9.807 1.00 0.00 N ATOM 771 NH2 ARG A 50 -4.991 -12.577 8.168 1.00 0.00 N ATOM 0 H ARG A 50 -5.670 -8.033 13.652 1.00 0.00 H new ATOM 0 HA ARG A 50 -8.163 -7.822 12.074 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -6.363 -9.030 10.862 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -6.167 -10.120 12.220 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -8.813 -10.471 11.874 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -8.443 -9.932 10.248 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -6.988 -12.221 11.660 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -8.321 -12.447 10.545 1.00 0.00 H new ATOM 0 HE ARG A 50 -6.451 -10.813 9.176 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -6.544 -14.061 10.600 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -5.358 -14.721 9.469 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -4.918 -11.667 7.713 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -4.435 -13.362 7.830 1.00 0.00 H new ATOM 785 N ASN A 51 -9.423 -8.757 13.976 1.00 0.00 N ATOM 786 CA ASN A 51 -10.219 -9.323 15.052 1.00 0.00 C ATOM 787 C ASN A 51 -9.839 -8.648 16.371 1.00 0.00 C ATOM 788 O ASN A 51 -10.373 -8.990 17.424 1.00 0.00 O ATOM 789 CB ASN A 51 -9.961 -10.824 15.197 1.00 0.00 C ATOM 790 CG ASN A 51 -9.885 -11.502 13.828 1.00 0.00 C ATOM 791 OD1 ASN A 51 -10.619 -11.184 12.907 1.00 0.00 O ATOM 792 ND2 ASN A 51 -8.958 -12.452 13.746 1.00 0.00 N ATOM 0 H ASN A 51 -9.915 -8.081 13.392 1.00 0.00 H new ATOM 0 HA ASN A 51 -11.270 -9.159 14.816 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -9.029 -10.986 15.739 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -10.757 -11.278 15.788 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -8.828 -12.964 12.873 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -8.377 -12.669 14.556 1.00 0.00 H new ATOM 799 N GLY A 52 -8.917 -7.701 16.270 1.00 0.00 N ATOM 800 CA GLY A 52 -8.459 -6.975 17.442 1.00 0.00 C ATOM 801 C GLY A 52 -7.011 -7.337 17.780 1.00 0.00 C ATOM 802 O GLY A 52 -6.359 -6.641 18.556 1.00 0.00 O ATOM 0 H GLY A 52 -8.475 -7.420 15.395 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -8.537 -5.903 17.263 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -9.103 -7.205 18.291 1.00 0.00 H new ATOM 806 N GLN A 53 -6.552 -8.426 17.181 1.00 0.00 N ATOM 807 CA GLN A 53 -5.194 -8.889 17.409 1.00 0.00 C ATOM 808 C GLN A 53 -4.262 -8.357 16.319 1.00 0.00 C ATOM 809 O GLN A 53 -4.684 -8.152 15.182 1.00 0.00 O ATOM 810 CB GLN A 53 -5.140 -10.417 17.479 1.00 0.00 C ATOM 811 CG GLN A 53 -5.011 -11.025 16.081 1.00 0.00 C ATOM 812 CD GLN A 53 -5.458 -12.489 16.077 1.00 0.00 C ATOM 813 OE1 GLN A 53 -5.442 -13.172 17.088 1.00 0.00 O ATOM 814 NE2 GLN A 53 -5.855 -12.929 14.887 1.00 0.00 N ATOM 0 H GLN A 53 -7.096 -9.001 16.538 1.00 0.00 H new ATOM 0 HA GLN A 53 -4.855 -8.502 18.370 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -4.295 -10.727 18.094 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -6.041 -10.795 17.962 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -5.615 -10.455 15.375 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -3.977 -10.956 15.744 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -5.843 -12.303 14.082 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -6.172 -13.893 14.779 1.00 0.00 H new ATOM 823 N VAL A 54 -3.012 -8.147 16.705 1.00 0.00 N ATOM 824 CA VAL A 54 -2.016 -7.643 15.774 1.00 0.00 C ATOM 825 C VAL A 54 -1.289 -8.821 15.123 1.00 0.00 C ATOM 826 O VAL A 54 -0.764 -9.691 15.817 1.00 0.00 O ATOM 827 CB VAL A 54 -1.070 -6.679 16.492 1.00 0.00 C ATOM 828 CG1 VAL A 54 0.304 -6.656 15.819 1.00 0.00 C ATOM 829 CG2 VAL A 54 -1.669 -5.273 16.563 1.00 0.00 C ATOM 0 H VAL A 54 -2.666 -8.317 17.649 1.00 0.00 H new ATOM 0 HA VAL A 54 -2.493 -7.075 14.975 1.00 0.00 H new ATOM 0 HB VAL A 54 -0.938 -7.038 17.513 1.00 0.00 H new ATOM 0 HG11 VAL A 54 0.957 -5.963 16.349 1.00 0.00 H new ATOM 0 HG12 VAL A 54 0.738 -7.655 15.844 1.00 0.00 H new ATOM 0 HG13 VAL A 54 0.197 -6.333 14.783 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -0.976 -4.608 17.078 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -1.846 -4.901 15.554 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -2.613 -5.307 17.108 1.00 0.00 H new ATOM 839 N ILE A 55 -1.281 -8.812 13.799 1.00 0.00 N ATOM 840 CA ILE A 55 -0.627 -9.869 13.047 1.00 0.00 C ATOM 841 C ILE A 55 0.749 -9.384 12.586 1.00 0.00 C ATOM 842 O ILE A 55 1.726 -10.130 12.645 1.00 0.00 O ATOM 843 CB ILE A 55 -1.524 -10.348 11.904 1.00 0.00 C ATOM 844 CG1 ILE A 55 -2.251 -9.173 11.248 1.00 0.00 C ATOM 845 CG2 ILE A 55 -2.497 -11.426 12.386 1.00 0.00 C ATOM 846 CD1 ILE A 55 -3.572 -8.877 11.961 1.00 0.00 C ATOM 0 H ILE A 55 -1.717 -8.089 13.227 1.00 0.00 H new ATOM 0 HA ILE A 55 -0.463 -10.741 13.680 1.00 0.00 H new ATOM 0 HB ILE A 55 -0.892 -10.802 11.141 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -1.615 -8.288 11.272 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -2.443 -9.399 10.199 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -3.123 -11.749 11.554 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -1.935 -12.278 12.770 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -3.127 -11.020 13.178 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -4.068 -8.037 11.474 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -4.216 -9.755 11.914 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -3.375 -8.627 13.003 1.00 0.00 H new ATOM 858 N TRP A 56 0.783 -8.138 12.137 1.00 0.00 N ATOM 859 CA TRP A 56 2.023 -7.546 11.666 1.00 0.00 C ATOM 860 C TRP A 56 2.213 -6.210 12.388 1.00 0.00 C ATOM 861 O TRP A 56 1.269 -5.432 12.520 1.00 0.00 O ATOM 862 CB TRP A 56 2.021 -7.406 10.143 1.00 0.00 C ATOM 863 CG TRP A 56 3.184 -6.579 9.591 1.00 0.00 C ATOM 864 CD1 TRP A 56 4.389 -7.011 9.197 1.00 0.00 C ATOM 865 CD2 TRP A 56 3.202 -5.150 9.388 1.00 0.00 C ATOM 866 NE1 TRP A 56 5.180 -5.969 8.756 1.00 0.00 N ATOM 867 CE2 TRP A 56 4.435 -4.802 8.876 1.00 0.00 C ATOM 868 CE3 TRP A 56 2.209 -4.184 9.628 1.00 0.00 C ATOM 869 CZ2 TRP A 56 4.790 -3.485 8.561 1.00 0.00 C ATOM 870 CZ3 TRP A 56 2.580 -2.873 9.308 1.00 0.00 C ATOM 871 CH2 TRP A 56 3.817 -2.506 8.792 1.00 0.00 C ATOM 0 H TRP A 56 -0.029 -7.522 12.089 1.00 0.00 H new ATOM 0 HA TRP A 56 2.870 -8.192 11.898 1.00 0.00 H new ATOM 0 HB2 TRP A 56 2.052 -8.400 9.697 1.00 0.00 H new ATOM 0 HB3 TRP A 56 1.083 -6.947 9.832 1.00 0.00 H new ATOM 0 HD1 TRP A 56 4.702 -8.044 9.221 1.00 0.00 H new ATOM 0 HE1 TRP A 56 6.135 -6.042 8.406 1.00 0.00 H new ATOM 0 HE3 TRP A 56 1.237 -4.434 10.028 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 5.762 -3.238 8.161 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 1.854 -2.091 9.474 1.00 0.00 H new ATOM 0 HH2 TRP A 56 4.027 -1.470 8.570 1.00 0.00 H new ATOM 882 N LYS A 57 3.439 -5.985 12.837 1.00 0.00 N ATOM 883 CA LYS A 57 3.765 -4.757 13.542 1.00 0.00 C ATOM 884 C LYS A 57 5.122 -4.241 13.059 1.00 0.00 C ATOM 885 O LYS A 57 6.144 -4.897 13.253 1.00 0.00 O ATOM 886 CB LYS A 57 3.692 -4.973 15.055 1.00 0.00 C ATOM 887 CG LYS A 57 4.559 -3.953 15.796 1.00 0.00 C ATOM 888 CD LYS A 57 3.886 -3.500 17.093 1.00 0.00 C ATOM 889 CE LYS A 57 2.748 -2.518 16.806 1.00 0.00 C ATOM 890 NZ LYS A 57 2.892 -1.301 17.636 1.00 0.00 N ATOM 0 H LYS A 57 4.219 -6.633 12.726 1.00 0.00 H new ATOM 0 HA LYS A 57 3.031 -3.983 13.318 1.00 0.00 H new ATOM 0 HB2 LYS A 57 2.658 -4.888 15.389 1.00 0.00 H new ATOM 0 HB3 LYS A 57 4.023 -5.983 15.298 1.00 0.00 H new ATOM 0 HG2 LYS A 57 5.531 -4.392 16.021 1.00 0.00 H new ATOM 0 HG3 LYS A 57 4.739 -3.090 15.155 1.00 0.00 H new ATOM 0 HD2 LYS A 57 3.497 -4.367 17.627 1.00 0.00 H new ATOM 0 HD3 LYS A 57 4.623 -3.029 17.744 1.00 0.00 H new ATOM 0 HE2 LYS A 57 2.751 -2.248 15.750 1.00 0.00 H new ATOM 0 HE3 LYS A 57 1.789 -2.994 17.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 1.973 -1.059 18.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 3.586 -1.476 18.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 3.218 -0.512 17.042 1.00 0.00 H new ATOM 904 N GLY A 58 5.087 -3.070 12.439 1.00 0.00 N ATOM 905 CA GLY A 58 6.301 -2.459 11.927 1.00 0.00 C ATOM 906 C GLY A 58 5.977 -1.262 11.031 1.00 0.00 C ATOM 907 O GLY A 58 5.011 -0.541 11.277 1.00 0.00 O ATOM 0 H GLY A 58 4.237 -2.529 12.280 1.00 0.00 H new ATOM 0 HA2 GLY A 58 6.928 -2.136 12.758 1.00 0.00 H new ATOM 0 HA3 GLY A 58 6.873 -3.196 11.363 1.00 0.00 H new ATOM 911 N SER A 59 6.802 -1.087 10.009 1.00 0.00 N ATOM 912 CA SER A 59 6.615 0.010 9.075 1.00 0.00 C ATOM 913 C SER A 59 6.290 -0.537 7.684 1.00 0.00 C ATOM 914 O SER A 59 6.854 -1.545 7.262 1.00 0.00 O ATOM 915 CB SER A 59 7.856 0.903 9.018 1.00 0.00 C ATOM 916 OG SER A 59 8.644 0.798 10.200 1.00 0.00 O ATOM 0 H SER A 59 7.602 -1.687 9.807 1.00 0.00 H new ATOM 0 HA SER A 59 5.780 0.617 9.424 1.00 0.00 H new ATOM 0 HB2 SER A 59 8.461 0.629 8.154 1.00 0.00 H new ATOM 0 HB3 SER A 59 7.550 1.940 8.877 1.00 0.00 H new ATOM 0 HG SER A 59 9.428 1.382 10.124 1.00 0.00 H new ATOM 922 N LEU A 60 5.381 0.152 7.009 1.00 0.00 N ATOM 923 CA LEU A 60 4.974 -0.252 5.674 1.00 0.00 C ATOM 924 C LEU A 60 6.196 -0.258 4.753 1.00 0.00 C ATOM 925 O LEU A 60 7.257 0.246 5.120 1.00 0.00 O ATOM 926 CB LEU A 60 3.830 0.631 5.172 1.00 0.00 C ATOM 927 CG LEU A 60 2.573 0.660 6.045 1.00 0.00 C ATOM 928 CD1 LEU A 60 1.586 1.719 5.549 1.00 0.00 C ATOM 929 CD2 LEU A 60 1.932 -0.727 6.128 1.00 0.00 C ATOM 0 H LEU A 60 4.915 0.988 7.362 1.00 0.00 H new ATOM 0 HA LEU A 60 4.579 -1.268 5.687 1.00 0.00 H new ATOM 0 HB2 LEU A 60 4.202 1.651 5.071 1.00 0.00 H new ATOM 0 HB3 LEU A 60 3.548 0.294 4.174 1.00 0.00 H new ATOM 0 HG LEU A 60 2.865 0.941 7.057 1.00 0.00 H new ATOM 0 HD11 LEU A 60 0.702 1.719 6.186 1.00 0.00 H new ATOM 0 HD12 LEU A 60 2.058 2.701 5.583 1.00 0.00 H new ATOM 0 HD13 LEU A 60 1.294 1.492 4.524 1.00 0.00 H new ATOM 0 HD21 LEU A 60 1.041 -0.679 6.754 1.00 0.00 H new ATOM 0 HD22 LEU A 60 1.655 -1.060 5.128 1.00 0.00 H new ATOM 0 HD23 LEU A 60 2.643 -1.431 6.561 1.00 0.00 H new ATOM 941 N THR A 61 6.006 -0.833 3.575 1.00 0.00 N ATOM 942 CA THR A 61 7.080 -0.911 2.598 1.00 0.00 C ATOM 943 C THR A 61 6.812 0.045 1.434 1.00 0.00 C ATOM 944 O THR A 61 7.739 0.456 0.738 1.00 0.00 O ATOM 945 CB THR A 61 7.220 -2.372 2.165 1.00 0.00 C ATOM 946 OG1 THR A 61 5.901 -2.746 1.775 1.00 0.00 O ATOM 947 CG2 THR A 61 7.540 -3.302 3.337 1.00 0.00 C ATOM 0 H THR A 61 5.125 -1.249 3.274 1.00 0.00 H new ATOM 0 HA THR A 61 8.030 -0.592 3.027 1.00 0.00 H new ATOM 0 HB THR A 61 8.004 -2.454 1.412 1.00 0.00 H new ATOM 0 HG1 THR A 61 5.384 -2.998 2.569 1.00 0.00 H new ATOM 0 HG21 THR A 61 7.629 -4.326 2.975 1.00 0.00 H new ATOM 0 HG22 THR A 61 8.480 -2.997 3.797 1.00 0.00 H new ATOM 0 HG23 THR A 61 6.740 -3.246 4.075 1.00 0.00 H new ATOM 955 N SER A 62 5.540 0.372 1.259 1.00 0.00 N ATOM 956 CA SER A 62 5.139 1.272 0.192 1.00 0.00 C ATOM 957 C SER A 62 3.692 1.723 0.404 1.00 0.00 C ATOM 958 O SER A 62 2.915 1.038 1.067 1.00 0.00 O ATOM 959 CB SER A 62 5.291 0.605 -1.177 1.00 0.00 C ATOM 960 OG SER A 62 6.428 -0.252 -1.230 1.00 0.00 O ATOM 0 H SER A 62 4.774 0.029 1.839 1.00 0.00 H new ATOM 0 HA SER A 62 5.792 2.144 0.216 1.00 0.00 H new ATOM 0 HB2 SER A 62 4.393 0.030 -1.402 1.00 0.00 H new ATOM 0 HB3 SER A 62 5.379 1.372 -1.946 1.00 0.00 H new ATOM 0 HG SER A 62 7.225 0.243 -0.946 1.00 0.00 H new ATOM 966 N LEU A 63 3.374 2.873 -0.172 1.00 0.00 N ATOM 967 CA LEU A 63 2.035 3.425 -0.054 1.00 0.00 C ATOM 968 C LEU A 63 1.763 4.351 -1.241 1.00 0.00 C ATOM 969 O LEU A 63 2.278 5.467 -1.293 1.00 0.00 O ATOM 970 CB LEU A 63 1.851 4.099 1.307 1.00 0.00 C ATOM 971 CG LEU A 63 0.544 4.870 1.502 1.00 0.00 C ATOM 972 CD1 LEU A 63 -0.615 3.918 1.802 1.00 0.00 C ATOM 973 CD2 LEU A 63 0.697 5.945 2.580 1.00 0.00 C ATOM 0 H LEU A 63 4.021 3.438 -0.722 1.00 0.00 H new ATOM 0 HA LEU A 63 1.291 2.630 -0.093 1.00 0.00 H new ATOM 0 HB2 LEU A 63 1.918 3.334 2.081 1.00 0.00 H new ATOM 0 HB3 LEU A 63 2.682 4.786 1.465 1.00 0.00 H new ATOM 0 HG LEU A 63 0.307 5.381 0.569 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -1.532 4.492 1.936 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -0.740 3.224 0.971 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -0.400 3.359 2.713 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -0.246 6.478 2.699 1.00 0.00 H new ATOM 0 HD22 LEU A 63 0.970 5.476 3.525 1.00 0.00 H new ATOM 0 HD23 LEU A 63 1.476 6.648 2.285 1.00 0.00 H new ATOM 985 N LYS A 64 0.955 3.853 -2.166 1.00 0.00 N ATOM 986 CA LYS A 64 0.609 4.623 -3.349 1.00 0.00 C ATOM 987 C LYS A 64 -0.890 4.928 -3.333 1.00 0.00 C ATOM 988 O LYS A 64 -1.651 4.280 -2.616 1.00 0.00 O ATOM 989 CB LYS A 64 1.076 3.899 -4.614 1.00 0.00 C ATOM 990 CG LYS A 64 2.601 3.776 -4.644 1.00 0.00 C ATOM 991 CD LYS A 64 3.114 3.677 -6.082 1.00 0.00 C ATOM 992 CE LYS A 64 4.053 2.480 -6.248 1.00 0.00 C ATOM 993 NZ LYS A 64 4.234 2.158 -7.681 1.00 0.00 N ATOM 0 H LYS A 64 0.530 2.927 -2.120 1.00 0.00 H new ATOM 0 HA LYS A 64 1.129 5.581 -3.347 1.00 0.00 H new ATOM 0 HB2 LYS A 64 0.627 2.907 -4.656 1.00 0.00 H new ATOM 0 HB3 LYS A 64 0.734 4.442 -5.495 1.00 0.00 H new ATOM 0 HG2 LYS A 64 3.049 4.640 -4.153 1.00 0.00 H new ATOM 0 HG3 LYS A 64 2.910 2.894 -4.082 1.00 0.00 H new ATOM 0 HD2 LYS A 64 2.271 3.580 -6.767 1.00 0.00 H new ATOM 0 HD3 LYS A 64 3.638 4.595 -6.349 1.00 0.00 H new ATOM 0 HE2 LYS A 64 5.019 2.702 -5.794 1.00 0.00 H new ATOM 0 HE3 LYS A 64 3.646 1.616 -5.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 4.874 1.344 -7.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 3.313 1.925 -8.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 4.643 2.978 -8.172 1.00 0.00 H new ATOM 1007 N HIS A 65 -1.269 5.914 -4.132 1.00 0.00 N ATOM 1008 CA HIS A 65 -2.664 6.313 -4.219 1.00 0.00 C ATOM 1009 C HIS A 65 -3.209 5.975 -5.608 1.00 0.00 C ATOM 1010 O HIS A 65 -3.613 6.866 -6.354 1.00 0.00 O ATOM 1011 CB HIS A 65 -2.830 7.791 -3.860 1.00 0.00 C ATOM 1012 CG HIS A 65 -4.160 8.376 -4.268 1.00 0.00 C ATOM 1013 ND1 HIS A 65 -5.355 7.690 -4.131 1.00 0.00 N ATOM 1014 CD2 HIS A 65 -4.473 9.589 -4.808 1.00 0.00 C ATOM 1015 CE1 HIS A 65 -6.335 8.465 -4.574 1.00 0.00 C ATOM 1016 NE2 HIS A 65 -5.786 9.641 -4.993 1.00 0.00 N ATOM 0 H HIS A 65 -0.635 6.449 -4.725 1.00 0.00 H new ATOM 0 HA HIS A 65 -3.252 5.754 -3.491 1.00 0.00 H new ATOM 0 HB2 HIS A 65 -2.708 7.909 -2.783 1.00 0.00 H new ATOM 0 HB3 HIS A 65 -2.032 8.362 -4.336 1.00 0.00 H new ATOM 0 HD1 HIS A 65 -5.463 6.749 -3.753 1.00 0.00 H new ATOM 0 HD2 HIS A 65 -3.771 10.374 -5.045 1.00 0.00 H new ATOM 0 HE1 HIS A 65 -7.384 8.210 -4.599 1.00 0.00 H new ATOM 1024 N HIS A 66 -3.203 4.686 -5.913 1.00 0.00 N ATOM 1025 CA HIS A 66 -3.692 4.220 -7.200 1.00 0.00 C ATOM 1026 C HIS A 66 -2.661 4.535 -8.286 1.00 0.00 C ATOM 1027 O HIS A 66 -1.997 3.635 -8.796 1.00 0.00 O ATOM 1028 CB HIS A 66 -5.071 4.808 -7.503 1.00 0.00 C ATOM 1029 CG HIS A 66 -6.156 3.772 -7.679 1.00 0.00 C ATOM 1030 ND1 HIS A 66 -6.310 2.695 -6.824 1.00 0.00 N ATOM 1031 CD2 HIS A 66 -7.137 3.661 -8.620 1.00 0.00 C ATOM 1032 CE1 HIS A 66 -7.340 1.974 -7.241 1.00 0.00 C ATOM 1033 NE2 HIS A 66 -7.851 2.574 -8.355 1.00 0.00 N ATOM 0 H HIS A 66 -2.868 3.950 -5.292 1.00 0.00 H new ATOM 0 HA HIS A 66 -3.821 3.138 -7.173 1.00 0.00 H new ATOM 0 HB2 HIS A 66 -5.353 5.481 -6.693 1.00 0.00 H new ATOM 0 HB3 HIS A 66 -5.007 5.410 -8.410 1.00 0.00 H new ATOM 0 HD2 HIS A 66 -7.304 4.342 -9.441 1.00 0.00 H new ATOM 0 HE1 HIS A 66 -7.710 1.070 -6.780 1.00 0.00 H new ATOM 0 HE2 HIS A 66 -8.650 2.242 -8.895 1.00 0.00 H new ATOM 1041 N LYS A 67 -2.561 5.817 -8.606 1.00 0.00 N ATOM 1042 CA LYS A 67 -1.622 6.263 -9.622 1.00 0.00 C ATOM 1043 C LYS A 67 -1.088 7.646 -9.245 1.00 0.00 C ATOM 1044 O LYS A 67 -1.477 8.649 -9.840 1.00 0.00 O ATOM 1045 CB LYS A 67 -2.268 6.211 -11.008 1.00 0.00 C ATOM 1046 CG LYS A 67 -2.059 4.843 -11.660 1.00 0.00 C ATOM 1047 CD LYS A 67 -2.678 4.800 -13.058 1.00 0.00 C ATOM 1048 CE LYS A 67 -2.878 3.357 -13.526 1.00 0.00 C ATOM 1049 NZ LYS A 67 -3.958 3.285 -14.536 1.00 0.00 N ATOM 0 H LYS A 67 -3.114 6.561 -8.180 1.00 0.00 H new ATOM 0 HA LYS A 67 -0.765 5.591 -9.669 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -3.335 6.418 -10.924 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -1.841 6.989 -11.641 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -0.993 4.626 -11.724 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -2.505 4.068 -11.037 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -3.636 5.320 -13.051 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -2.034 5.328 -13.761 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -1.950 2.974 -13.950 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -3.125 2.723 -12.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -4.081 2.299 -14.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -4.846 3.631 -14.120 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -3.707 3.874 -15.355 1.00 0.00 H new ATOM 1063 N ASP A 68 -0.204 7.654 -8.258 1.00 0.00 N ATOM 1064 CA ASP A 68 0.389 8.897 -7.794 1.00 0.00 C ATOM 1065 C ASP A 68 1.167 8.635 -6.503 1.00 0.00 C ATOM 1066 O ASP A 68 0.585 8.256 -5.488 1.00 0.00 O ATOM 1067 CB ASP A 68 -0.688 9.941 -7.493 1.00 0.00 C ATOM 1068 CG ASP A 68 -0.483 11.296 -8.173 1.00 0.00 C ATOM 1069 OD1 ASP A 68 -0.451 11.304 -9.423 1.00 0.00 O ATOM 1070 OD2 ASP A 68 -0.363 12.293 -7.429 1.00 0.00 O ATOM 0 H ASP A 68 0.116 6.819 -7.767 1.00 0.00 H new ATOM 0 HA ASP A 68 1.046 9.272 -8.579 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -1.655 9.541 -7.797 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -0.732 10.095 -6.415 1.00 0.00 H new ATOM 1075 N ASP A 69 2.473 8.847 -6.584 1.00 0.00 N ATOM 1076 CA ASP A 69 3.337 8.639 -5.435 1.00 0.00 C ATOM 1077 C ASP A 69 3.080 9.738 -4.402 1.00 0.00 C ATOM 1078 O ASP A 69 3.816 10.721 -4.340 1.00 0.00 O ATOM 1079 CB ASP A 69 4.812 8.703 -5.836 1.00 0.00 C ATOM 1080 CG ASP A 69 5.149 8.033 -7.170 1.00 0.00 C ATOM 1081 OD1 ASP A 69 5.200 6.785 -7.180 1.00 0.00 O ATOM 1082 OD2 ASP A 69 5.349 8.785 -8.148 1.00 0.00 O ATOM 0 H ASP A 69 2.953 9.161 -7.428 1.00 0.00 H new ATOM 0 HA ASP A 69 3.117 7.654 -5.023 1.00 0.00 H new ATOM 0 HB2 ASP A 69 5.115 9.749 -5.885 1.00 0.00 H new ATOM 0 HB3 ASP A 69 5.407 8.236 -5.051 1.00 0.00 H new ATOM 1087 N ILE A 70 2.032 9.535 -3.617 1.00 0.00 N ATOM 1088 CA ILE A 70 1.668 10.497 -2.591 1.00 0.00 C ATOM 1089 C ILE A 70 2.268 10.059 -1.253 1.00 0.00 C ATOM 1090 O ILE A 70 2.615 8.893 -1.076 1.00 0.00 O ATOM 1091 CB ILE A 70 0.151 10.690 -2.551 1.00 0.00 C ATOM 1092 CG1 ILE A 70 -0.220 11.958 -1.780 1.00 0.00 C ATOM 1093 CG2 ILE A 70 -0.545 9.450 -1.985 1.00 0.00 C ATOM 1094 CD1 ILE A 70 -1.697 12.308 -1.978 1.00 0.00 C ATOM 0 H ILE A 70 1.423 8.718 -3.671 1.00 0.00 H new ATOM 0 HA ILE A 70 2.084 11.477 -2.823 1.00 0.00 H new ATOM 0 HB ILE A 70 -0.204 10.820 -3.573 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -0.015 11.816 -0.719 1.00 0.00 H new ATOM 0 HG13 ILE A 70 0.402 12.787 -2.116 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -1.622 9.614 -1.968 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -0.319 8.588 -2.612 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -0.190 9.264 -0.971 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -1.934 13.213 -1.419 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -1.893 12.474 -3.037 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -2.317 11.487 -1.618 1.00 0.00 H new ATOM 1106 N SER A 71 2.371 11.019 -0.345 1.00 0.00 N ATOM 1107 CA SER A 71 2.923 10.747 0.972 1.00 0.00 C ATOM 1108 C SER A 71 1.807 10.326 1.930 1.00 0.00 C ATOM 1109 O SER A 71 1.848 9.233 2.493 1.00 0.00 O ATOM 1110 CB SER A 71 3.661 11.969 1.522 1.00 0.00 C ATOM 1111 OG SER A 71 3.487 12.109 2.929 1.00 0.00 O ATOM 0 H SER A 71 2.082 11.986 -0.495 1.00 0.00 H new ATOM 0 HA SER A 71 3.641 9.932 0.881 1.00 0.00 H new ATOM 0 HB2 SER A 71 4.724 11.883 1.295 1.00 0.00 H new ATOM 0 HB3 SER A 71 3.299 12.867 1.021 1.00 0.00 H new ATOM 0 HG SER A 71 3.975 12.899 3.242 1.00 0.00 H new ATOM 1117 N VAL A 72 0.836 11.214 2.085 1.00 0.00 N ATOM 1118 CA VAL A 72 -0.289 10.948 2.965 1.00 0.00 C ATOM 1119 C VAL A 72 -1.507 10.561 2.125 1.00 0.00 C ATOM 1120 O VAL A 72 -1.536 10.801 0.919 1.00 0.00 O ATOM 1121 CB VAL A 72 -0.544 12.156 3.868 1.00 0.00 C ATOM 1122 CG1 VAL A 72 0.740 12.593 4.576 1.00 0.00 C ATOM 1123 CG2 VAL A 72 -1.154 13.314 3.076 1.00 0.00 C ATOM 0 H VAL A 72 0.805 12.119 1.616 1.00 0.00 H new ATOM 0 HA VAL A 72 -0.069 10.108 3.624 1.00 0.00 H new ATOM 0 HB VAL A 72 -1.262 11.857 4.631 1.00 0.00 H new ATOM 0 HG11 VAL A 72 0.530 13.453 5.211 1.00 0.00 H new ATOM 0 HG12 VAL A 72 1.115 11.773 5.188 1.00 0.00 H new ATOM 0 HG13 VAL A 72 1.490 12.865 3.834 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -1.325 14.160 3.742 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -0.470 13.611 2.281 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -2.102 12.998 2.640 1.00 0.00 H new ATOM 1133 N ILE A 73 -2.485 9.969 2.795 1.00 0.00 N ATOM 1134 CA ILE A 73 -3.703 9.547 2.126 1.00 0.00 C ATOM 1135 C ILE A 73 -4.913 10.105 2.878 1.00 0.00 C ATOM 1136 O ILE A 73 -5.303 9.570 3.915 1.00 0.00 O ATOM 1137 CB ILE A 73 -3.727 8.026 1.964 1.00 0.00 C ATOM 1138 CG1 ILE A 73 -2.563 7.549 1.093 1.00 0.00 C ATOM 1139 CG2 ILE A 73 -5.078 7.552 1.426 1.00 0.00 C ATOM 1140 CD1 ILE A 73 -2.757 7.978 -0.363 1.00 0.00 C ATOM 0 H ILE A 73 -2.458 9.772 3.795 1.00 0.00 H new ATOM 0 HA ILE A 73 -3.741 9.952 1.115 1.00 0.00 H new ATOM 0 HB ILE A 73 -3.598 7.576 2.948 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -1.627 7.957 1.475 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -2.483 6.463 1.149 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -5.067 6.467 1.321 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -5.868 7.841 2.119 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -5.263 8.009 0.454 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -1.916 7.627 -0.961 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -3.681 7.548 -0.749 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -2.812 9.065 -0.418 1.00 0.00 H new ATOM 1152 N LYS A 74 -5.473 11.171 2.327 1.00 0.00 N ATOM 1153 CA LYS A 74 -6.631 11.807 2.933 1.00 0.00 C ATOM 1154 C LYS A 74 -7.764 10.786 3.052 1.00 0.00 C ATOM 1155 O LYS A 74 -7.628 9.648 2.604 1.00 0.00 O ATOM 1156 CB LYS A 74 -7.017 13.067 2.157 1.00 0.00 C ATOM 1157 CG LYS A 74 -5.887 14.098 2.188 1.00 0.00 C ATOM 1158 CD LYS A 74 -6.207 15.290 1.283 1.00 0.00 C ATOM 1159 CE LYS A 74 -4.926 15.977 0.807 1.00 0.00 C ATOM 1160 NZ LYS A 74 -5.085 17.448 0.836 1.00 0.00 N ATOM 0 H LYS A 74 -5.147 11.611 1.467 1.00 0.00 H new ATOM 0 HA LYS A 74 -6.397 12.142 3.943 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -7.248 12.806 1.124 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -7.921 13.500 2.586 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -5.733 14.444 3.210 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -4.956 13.632 1.866 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -6.784 14.953 0.422 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -6.828 16.005 1.823 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -4.091 15.683 1.443 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -4.686 15.651 -0.205 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -4.206 17.899 0.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -5.869 17.725 0.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -5.292 17.756 1.808 1.00 0.00 H new ATOM 1174 N THR A 75 -8.856 11.229 3.657 1.00 0.00 N ATOM 1175 CA THR A 75 -10.012 10.368 3.840 1.00 0.00 C ATOM 1176 C THR A 75 -10.740 10.163 2.510 1.00 0.00 C ATOM 1177 O THR A 75 -10.796 11.071 1.683 1.00 0.00 O ATOM 1178 CB THR A 75 -10.894 10.985 4.927 1.00 0.00 C ATOM 1179 OG1 THR A 75 -10.044 11.048 6.069 1.00 0.00 O ATOM 1180 CG2 THR A 75 -12.029 10.055 5.358 1.00 0.00 C ATOM 0 H THR A 75 -8.965 12.173 4.027 1.00 0.00 H new ATOM 0 HA THR A 75 -9.715 9.372 4.169 1.00 0.00 H new ATOM 0 HB THR A 75 -11.312 11.924 4.565 1.00 0.00 H new ATOM 0 HG1 THR A 75 -10.536 11.438 6.822 1.00 0.00 H new ATOM 0 HG21 THR A 75 -12.624 10.541 6.131 1.00 0.00 H new ATOM 0 HG22 THR A 75 -12.662 9.831 4.499 1.00 0.00 H new ATOM 0 HG23 THR A 75 -11.611 9.129 5.751 1.00 0.00 H new ATOM 1188 N GLY A 76 -11.279 8.964 2.346 1.00 0.00 N ATOM 1189 CA GLY A 76 -12.002 8.628 1.131 1.00 0.00 C ATOM 1190 C GLY A 76 -11.041 8.178 0.029 1.00 0.00 C ATOM 1191 O GLY A 76 -11.470 7.651 -0.996 1.00 0.00 O ATOM 0 H GLY A 76 -11.230 8.213 3.034 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -12.720 7.835 1.338 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -12.571 9.493 0.791 1.00 0.00 H new ATOM 1195 N MET A 77 -9.759 8.401 0.278 1.00 0.00 N ATOM 1196 CA MET A 77 -8.734 8.025 -0.681 1.00 0.00 C ATOM 1197 C MET A 77 -8.363 6.547 -0.535 1.00 0.00 C ATOM 1198 O MET A 77 -8.065 6.084 0.564 1.00 0.00 O ATOM 1199 CB MET A 77 -7.489 8.887 -0.462 1.00 0.00 C ATOM 1200 CG MET A 77 -7.729 10.324 -0.930 1.00 0.00 C ATOM 1201 SD MET A 77 -6.785 10.651 -2.409 1.00 0.00 S ATOM 1202 CE MET A 77 -5.145 10.261 -1.822 1.00 0.00 C ATOM 0 H MET A 77 -9.407 8.837 1.130 1.00 0.00 H new ATOM 0 HA MET A 77 -9.126 8.185 -1.685 1.00 0.00 H new ATOM 0 HB2 MET A 77 -7.222 8.885 0.595 1.00 0.00 H new ATOM 0 HB3 MET A 77 -6.646 8.460 -1.005 1.00 0.00 H new ATOM 0 HG2 MET A 77 -8.790 10.479 -1.124 1.00 0.00 H new ATOM 0 HG3 MET A 77 -7.443 11.023 -0.144 1.00 0.00 H new ATOM 0 HE1 MET A 77 -4.406 10.761 -2.448 1.00 0.00 H new ATOM 0 HE2 MET A 77 -5.037 10.600 -0.792 1.00 0.00 H new ATOM 0 HE3 MET A 77 -4.989 9.183 -1.867 1.00 0.00 H new ATOM 1212 N ASP A 78 -8.395 5.849 -1.661 1.00 0.00 N ATOM 1213 CA ASP A 78 -8.066 4.434 -1.673 1.00 0.00 C ATOM 1214 C ASP A 78 -6.578 4.263 -1.983 1.00 0.00 C ATOM 1215 O ASP A 78 -6.081 4.802 -2.971 1.00 0.00 O ATOM 1216 CB ASP A 78 -8.862 3.693 -2.749 1.00 0.00 C ATOM 1217 CG ASP A 78 -10.245 4.275 -3.047 1.00 0.00 C ATOM 1218 OD1 ASP A 78 -11.040 4.369 -2.087 1.00 0.00 O ATOM 1219 OD2 ASP A 78 -10.477 4.613 -4.228 1.00 0.00 O ATOM 0 H ASP A 78 -8.644 6.237 -2.571 1.00 0.00 H new ATOM 0 HA ASP A 78 -8.312 4.022 -0.694 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -8.280 3.688 -3.671 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -8.980 2.654 -2.441 1.00 0.00 H new ATOM 1224 N CYS A 79 -5.909 3.511 -1.122 1.00 0.00 N ATOM 1225 CA CYS A 79 -4.488 3.262 -1.292 1.00 0.00 C ATOM 1226 C CYS A 79 -4.205 1.808 -0.907 1.00 0.00 C ATOM 1227 O CYS A 79 -4.993 1.186 -0.197 1.00 0.00 O ATOM 1228 CB CYS A 79 -3.641 4.243 -0.479 1.00 0.00 C ATOM 1229 SG CYS A 79 -4.040 4.089 1.300 1.00 0.00 S ATOM 0 H CYS A 79 -6.325 3.066 -0.304 1.00 0.00 H new ATOM 0 HA CYS A 79 -4.210 3.421 -2.334 1.00 0.00 H new ATOM 0 HB2 CYS A 79 -2.582 4.043 -0.641 1.00 0.00 H new ATOM 0 HB3 CYS A 79 -3.828 5.263 -0.815 1.00 0.00 H new ATOM 0 HG CYS A 79 -5.298 4.357 1.487 1.00 0.00 H new ATOM 1235 N GLY A 80 -3.077 1.310 -1.393 1.00 0.00 N ATOM 1236 CA GLY A 80 -2.681 -0.059 -1.109 1.00 0.00 C ATOM 1237 C GLY A 80 -1.265 -0.110 -0.529 1.00 0.00 C ATOM 1238 O GLY A 80 -0.314 0.343 -1.164 1.00 0.00 O ATOM 0 H GLY A 80 -2.425 1.830 -1.981 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -3.383 -0.506 -0.405 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -2.725 -0.651 -2.023 1.00 0.00 H new ATOM 1242 N LEU A 81 -1.171 -0.667 0.670 1.00 0.00 N ATOM 1243 CA LEU A 81 0.112 -0.783 1.342 1.00 0.00 C ATOM 1244 C LEU A 81 0.531 -2.254 1.379 1.00 0.00 C ATOM 1245 O LEU A 81 -0.271 -3.140 1.086 1.00 0.00 O ATOM 1246 CB LEU A 81 0.056 -0.125 2.722 1.00 0.00 C ATOM 1247 CG LEU A 81 -0.988 -0.685 3.690 1.00 0.00 C ATOM 1248 CD1 LEU A 81 -0.436 -1.891 4.453 1.00 0.00 C ATOM 1249 CD2 LEU A 81 -1.501 0.404 4.634 1.00 0.00 C ATOM 0 H LEU A 81 -1.962 -1.043 1.193 1.00 0.00 H new ATOM 0 HA LEU A 81 0.882 -0.245 0.789 1.00 0.00 H new ATOM 0 HB2 LEU A 81 1.038 -0.216 3.186 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -0.136 0.939 2.588 1.00 0.00 H new ATOM 0 HG LEU A 81 -1.841 -1.034 3.108 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -1.198 -2.270 5.134 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -0.160 -2.673 3.746 1.00 0.00 H new ATOM 0 HD13 LEU A 81 0.443 -1.590 5.023 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -2.242 -0.021 5.311 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -0.669 0.806 5.212 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -1.958 1.204 4.052 1.00 0.00 H new ATOM 1261 N SER A 82 1.788 -2.469 1.741 1.00 0.00 N ATOM 1262 CA SER A 82 2.323 -3.817 1.820 1.00 0.00 C ATOM 1263 C SER A 82 3.319 -3.918 2.977 1.00 0.00 C ATOM 1264 O SER A 82 3.969 -2.934 3.328 1.00 0.00 O ATOM 1265 CB SER A 82 2.994 -4.221 0.506 1.00 0.00 C ATOM 1266 OG SER A 82 3.639 -5.488 0.603 1.00 0.00 O ATOM 0 H SER A 82 2.451 -1.732 1.983 1.00 0.00 H new ATOM 0 HA SER A 82 1.495 -4.503 2.000 1.00 0.00 H new ATOM 0 HB2 SER A 82 2.247 -4.254 -0.287 1.00 0.00 H new ATOM 0 HB3 SER A 82 3.725 -3.463 0.224 1.00 0.00 H new ATOM 0 HG SER A 82 3.063 -6.179 0.214 1.00 0.00 H new ATOM 1272 N LEU A 83 3.407 -5.115 3.538 1.00 0.00 N ATOM 1273 CA LEU A 83 4.313 -5.357 4.648 1.00 0.00 C ATOM 1274 C LEU A 83 5.545 -6.110 4.141 1.00 0.00 C ATOM 1275 O LEU A 83 5.450 -6.903 3.205 1.00 0.00 O ATOM 1276 CB LEU A 83 3.584 -6.068 5.789 1.00 0.00 C ATOM 1277 CG LEU A 83 2.127 -5.656 6.014 1.00 0.00 C ATOM 1278 CD1 LEU A 83 1.409 -6.656 6.922 1.00 0.00 C ATOM 1279 CD2 LEU A 83 2.039 -4.227 6.553 1.00 0.00 C ATOM 0 H LEU A 83 2.866 -5.928 3.245 1.00 0.00 H new ATOM 0 HA LEU A 83 4.665 -4.413 5.065 1.00 0.00 H new ATOM 0 HB2 LEU A 83 3.612 -7.141 5.599 1.00 0.00 H new ATOM 0 HB3 LEU A 83 4.137 -5.893 6.712 1.00 0.00 H new ATOM 0 HG LEU A 83 1.615 -5.670 5.052 1.00 0.00 H new ATOM 0 HD11 LEU A 83 0.376 -6.340 7.066 1.00 0.00 H new ATOM 0 HD12 LEU A 83 1.426 -7.643 6.461 1.00 0.00 H new ATOM 0 HD13 LEU A 83 1.913 -6.698 7.887 1.00 0.00 H new ATOM 0 HD21 LEU A 83 0.993 -3.959 6.704 1.00 0.00 H new ATOM 0 HD22 LEU A 83 2.571 -4.163 7.502 1.00 0.00 H new ATOM 0 HD23 LEU A 83 2.490 -3.540 5.837 1.00 0.00 H new ATOM 1291 N ASP A 84 6.671 -5.836 4.782 1.00 0.00 N ATOM 1292 CA ASP A 84 7.920 -6.478 4.408 1.00 0.00 C ATOM 1293 C ASP A 84 7.802 -7.986 4.640 1.00 0.00 C ATOM 1294 O ASP A 84 8.541 -8.769 4.043 1.00 0.00 O ATOM 1295 CB ASP A 84 9.082 -5.959 5.257 1.00 0.00 C ATOM 1296 CG ASP A 84 8.937 -6.189 6.762 1.00 0.00 C ATOM 1297 OD1 ASP A 84 8.346 -5.304 7.418 1.00 0.00 O ATOM 1298 OD2 ASP A 84 9.420 -7.246 7.224 1.00 0.00 O ATOM 0 H ASP A 84 6.745 -5.178 5.558 1.00 0.00 H new ATOM 0 HA ASP A 84 8.113 -6.255 3.359 1.00 0.00 H new ATOM 0 HB2 ASP A 84 10.001 -6.437 4.919 1.00 0.00 H new ATOM 0 HB3 ASP A 84 9.194 -4.890 5.077 1.00 0.00 H new ATOM 1303 N GLU A 85 6.868 -8.348 5.507 1.00 0.00 N ATOM 1304 CA GLU A 85 6.645 -9.749 5.824 1.00 0.00 C ATOM 1305 C GLU A 85 5.443 -10.284 5.044 1.00 0.00 C ATOM 1306 O GLU A 85 4.355 -10.436 5.599 1.00 0.00 O ATOM 1307 CB GLU A 85 6.454 -9.946 7.329 1.00 0.00 C ATOM 1308 CG GLU A 85 6.914 -11.339 7.763 1.00 0.00 C ATOM 1309 CD GLU A 85 8.418 -11.355 8.047 1.00 0.00 C ATOM 1310 OE1 GLU A 85 9.181 -11.457 7.062 1.00 0.00 O ATOM 1311 OE2 GLU A 85 8.770 -11.266 9.243 1.00 0.00 O ATOM 0 H GLU A 85 6.257 -7.696 6.000 1.00 0.00 H new ATOM 0 HA GLU A 85 7.528 -10.315 5.526 1.00 0.00 H new ATOM 0 HB2 GLU A 85 7.017 -9.187 7.873 1.00 0.00 H new ATOM 0 HB3 GLU A 85 5.404 -9.809 7.587 1.00 0.00 H new ATOM 0 HG2 GLU A 85 6.368 -11.645 8.656 1.00 0.00 H new ATOM 0 HG3 GLU A 85 6.680 -12.063 6.983 1.00 0.00 H new ATOM 1318 N GLU A 86 5.678 -10.555 3.769 1.00 0.00 N ATOM 1319 CA GLU A 86 4.628 -11.071 2.907 1.00 0.00 C ATOM 1320 C GLU A 86 3.825 -12.150 3.636 1.00 0.00 C ATOM 1321 O GLU A 86 2.651 -12.364 3.336 1.00 0.00 O ATOM 1322 CB GLU A 86 5.209 -11.610 1.598 1.00 0.00 C ATOM 1323 CG GLU A 86 6.217 -12.730 1.865 1.00 0.00 C ATOM 1324 CD GLU A 86 5.676 -14.079 1.387 1.00 0.00 C ATOM 1325 OE1 GLU A 86 4.511 -14.377 1.728 1.00 0.00 O ATOM 1326 OE2 GLU A 86 6.441 -14.782 0.692 1.00 0.00 O ATOM 0 H GLU A 86 6.581 -10.427 3.312 1.00 0.00 H new ATOM 0 HA GLU A 86 3.954 -10.251 2.657 1.00 0.00 H new ATOM 0 HB2 GLU A 86 4.404 -11.984 0.965 1.00 0.00 H new ATOM 0 HB3 GLU A 86 5.695 -10.802 1.051 1.00 0.00 H new ATOM 0 HG2 GLU A 86 7.155 -12.509 1.356 1.00 0.00 H new ATOM 0 HG3 GLU A 86 6.437 -12.780 2.931 1.00 0.00 H new ATOM 1333 N LYS A 87 4.489 -12.800 4.580 1.00 0.00 N ATOM 1334 CA LYS A 87 3.851 -13.852 5.354 1.00 0.00 C ATOM 1335 C LYS A 87 2.500 -13.352 5.869 1.00 0.00 C ATOM 1336 O LYS A 87 1.490 -14.043 5.745 1.00 0.00 O ATOM 1337 CB LYS A 87 4.787 -14.346 6.460 1.00 0.00 C ATOM 1338 CG LYS A 87 5.894 -15.232 5.886 1.00 0.00 C ATOM 1339 CD LYS A 87 6.517 -16.107 6.976 1.00 0.00 C ATOM 1340 CE LYS A 87 8.024 -15.865 7.079 1.00 0.00 C ATOM 1341 NZ LYS A 87 8.616 -16.725 8.127 1.00 0.00 N ATOM 0 H LYS A 87 5.462 -12.619 4.827 1.00 0.00 H new ATOM 0 HA LYS A 87 3.651 -14.720 4.726 1.00 0.00 H new ATOM 0 HB2 LYS A 87 5.229 -13.493 6.975 1.00 0.00 H new ATOM 0 HB3 LYS A 87 4.216 -14.905 7.201 1.00 0.00 H new ATOM 0 HG2 LYS A 87 5.487 -15.863 5.096 1.00 0.00 H new ATOM 0 HG3 LYS A 87 6.664 -14.609 5.431 1.00 0.00 H new ATOM 0 HD2 LYS A 87 6.044 -15.892 7.934 1.00 0.00 H new ATOM 0 HD3 LYS A 87 6.328 -17.158 6.756 1.00 0.00 H new ATOM 0 HE2 LYS A 87 8.498 -16.072 6.120 1.00 0.00 H new ATOM 0 HE3 LYS A 87 8.215 -14.817 7.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 9.639 -16.548 8.184 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 8.176 -16.508 9.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 8.450 -17.724 7.891 1.00 0.00 H new ATOM 1355 N VAL A 88 2.526 -12.155 6.437 1.00 0.00 N ATOM 1356 CA VAL A 88 1.315 -11.555 6.972 1.00 0.00 C ATOM 1357 C VAL A 88 0.341 -11.274 5.826 1.00 0.00 C ATOM 1358 O VAL A 88 0.703 -10.629 4.843 1.00 0.00 O ATOM 1359 CB VAL A 88 1.665 -10.303 7.780 1.00 0.00 C ATOM 1360 CG1 VAL A 88 0.416 -9.705 8.431 1.00 0.00 C ATOM 1361 CG2 VAL A 88 2.737 -10.609 8.828 1.00 0.00 C ATOM 0 H VAL A 88 3.366 -11.585 6.538 1.00 0.00 H new ATOM 0 HA VAL A 88 0.819 -12.241 7.659 1.00 0.00 H new ATOM 0 HB VAL A 88 2.072 -9.562 7.092 1.00 0.00 H new ATOM 0 HG11 VAL A 88 0.692 -8.817 8.999 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -0.302 -9.433 7.658 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -0.032 -10.439 9.100 1.00 0.00 H new ATOM 0 HG21 VAL A 88 2.967 -9.703 9.388 1.00 0.00 H new ATOM 0 HG22 VAL A 88 2.370 -11.375 9.511 1.00 0.00 H new ATOM 0 HG23 VAL A 88 3.639 -10.968 8.332 1.00 0.00 H new ATOM 1371 N GLU A 89 -0.875 -11.773 5.990 1.00 0.00 N ATOM 1372 CA GLU A 89 -1.904 -11.583 4.982 1.00 0.00 C ATOM 1373 C GLU A 89 -3.057 -10.753 5.549 1.00 0.00 C ATOM 1374 O GLU A 89 -3.505 -10.991 6.670 1.00 0.00 O ATOM 1375 CB GLU A 89 -2.405 -12.928 4.451 1.00 0.00 C ATOM 1376 CG GLU A 89 -3.772 -12.777 3.780 1.00 0.00 C ATOM 1377 CD GLU A 89 -4.257 -14.115 3.218 1.00 0.00 C ATOM 1378 OE1 GLU A 89 -3.440 -14.776 2.541 1.00 0.00 O ATOM 1379 OE2 GLU A 89 -5.434 -14.446 3.477 1.00 0.00 O ATOM 0 H GLU A 89 -1.171 -12.309 6.806 1.00 0.00 H new ATOM 0 HA GLU A 89 -1.469 -11.038 4.145 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -1.687 -13.331 3.736 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -2.475 -13.643 5.270 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -4.496 -12.398 4.502 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -3.708 -12.043 2.977 1.00 0.00 H new ATOM 1386 N PHE A 90 -3.505 -9.796 4.750 1.00 0.00 N ATOM 1387 CA PHE A 90 -4.598 -8.930 5.158 1.00 0.00 C ATOM 1388 C PHE A 90 -5.951 -9.544 4.793 1.00 0.00 C ATOM 1389 O PHE A 90 -6.021 -10.454 3.968 1.00 0.00 O ATOM 1390 CB PHE A 90 -4.429 -7.611 4.402 1.00 0.00 C ATOM 1391 CG PHE A 90 -2.973 -7.241 4.113 1.00 0.00 C ATOM 1392 CD1 PHE A 90 -2.261 -6.522 5.022 1.00 0.00 C ATOM 1393 CD2 PHE A 90 -2.390 -7.630 2.947 1.00 0.00 C ATOM 1394 CE1 PHE A 90 -0.909 -6.179 4.755 1.00 0.00 C ATOM 1395 CE2 PHE A 90 -1.039 -7.286 2.680 1.00 0.00 C ATOM 1396 CZ PHE A 90 -0.327 -6.568 3.589 1.00 0.00 C ATOM 0 H PHE A 90 -3.131 -9.601 3.821 1.00 0.00 H new ATOM 0 HA PHE A 90 -4.575 -8.786 6.238 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -4.971 -7.673 3.459 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -4.888 -6.810 4.982 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -2.724 -6.212 5.947 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -2.955 -8.200 2.225 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -0.343 -5.610 5.478 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -0.576 -7.595 1.754 1.00 0.00 H new ATOM 0 HZ PHE A 90 0.701 -6.307 3.385 1.00 0.00 H new ATOM 1406 N LYS A 91 -6.991 -9.022 5.425 1.00 0.00 N ATOM 1407 CA LYS A 91 -8.338 -9.508 5.177 1.00 0.00 C ATOM 1408 C LYS A 91 -9.317 -8.333 5.231 1.00 0.00 C ATOM 1409 O LYS A 91 -9.033 -7.312 5.854 1.00 0.00 O ATOM 1410 CB LYS A 91 -8.685 -10.642 6.144 1.00 0.00 C ATOM 1411 CG LYS A 91 -8.417 -12.007 5.506 1.00 0.00 C ATOM 1412 CD LYS A 91 -9.690 -12.857 5.474 1.00 0.00 C ATOM 1413 CE LYS A 91 -9.352 -14.349 5.461 1.00 0.00 C ATOM 1414 NZ LYS A 91 -9.232 -14.865 6.843 1.00 0.00 N ATOM 0 H LYS A 91 -6.929 -8.267 6.108 1.00 0.00 H new ATOM 0 HA LYS A 91 -8.410 -9.938 4.178 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -8.096 -10.541 7.056 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -9.734 -10.571 6.432 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -8.041 -11.871 4.492 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -7.641 -12.528 6.067 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -10.307 -12.628 6.343 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -10.277 -12.606 4.591 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -10.127 -14.899 4.927 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -8.418 -14.512 4.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -9.002 -15.879 6.816 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -8.477 -14.352 7.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -10.133 -14.727 7.344 1.00 0.00 H new ATOM 1428 N PRO A 92 -10.480 -8.523 4.553 1.00 0.00 N ATOM 1429 CA PRO A 92 -11.503 -7.492 4.517 1.00 0.00 C ATOM 1430 C PRO A 92 -12.252 -7.416 5.850 1.00 0.00 C ATOM 1431 O PRO A 92 -13.478 -7.513 5.883 1.00 0.00 O ATOM 1432 CB PRO A 92 -12.402 -7.869 3.351 1.00 0.00 C ATOM 1433 CG PRO A 92 -12.126 -9.337 3.069 1.00 0.00 C ATOM 1434 CD PRO A 92 -10.852 -9.720 3.804 1.00 0.00 C ATOM 0 HA PRO A 92 -11.089 -6.494 4.376 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -13.451 -7.710 3.600 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -12.185 -7.256 2.476 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -12.960 -9.954 3.404 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -12.015 -9.506 1.998 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -11.018 -10.567 4.469 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -10.066 -10.011 3.108 1.00 0.00 H new ATOM 1442 N GLY A 93 -11.483 -7.244 6.915 1.00 0.00 N ATOM 1443 CA GLY A 93 -12.059 -7.155 8.246 1.00 0.00 C ATOM 1444 C GLY A 93 -10.976 -6.897 9.295 1.00 0.00 C ATOM 1445 O GLY A 93 -11.071 -7.379 10.423 1.00 0.00 O ATOM 0 H GLY A 93 -10.467 -7.164 6.883 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -12.796 -6.353 8.274 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -12.585 -8.080 8.481 1.00 0.00 H new ATOM 1449 N ASP A 94 -9.970 -6.137 8.887 1.00 0.00 N ATOM 1450 CA ASP A 94 -8.870 -5.808 9.778 1.00 0.00 C ATOM 1451 C ASP A 94 -8.836 -4.296 10.003 1.00 0.00 C ATOM 1452 O ASP A 94 -9.779 -3.590 9.647 1.00 0.00 O ATOM 1453 CB ASP A 94 -7.528 -6.227 9.173 1.00 0.00 C ATOM 1454 CG ASP A 94 -7.504 -7.628 8.561 1.00 0.00 C ATOM 1455 OD1 ASP A 94 -8.583 -8.260 8.545 1.00 0.00 O ATOM 1456 OD2 ASP A 94 -6.407 -8.037 8.122 1.00 0.00 O ATOM 0 H ASP A 94 -9.894 -5.739 7.951 1.00 0.00 H new ATOM 0 HA ASP A 94 -9.025 -6.341 10.716 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -7.253 -5.506 8.403 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -6.764 -6.173 9.949 1.00 0.00 H new ATOM 1461 N GLN A 95 -7.740 -3.842 10.594 1.00 0.00 N ATOM 1462 CA GLN A 95 -7.571 -2.426 10.871 1.00 0.00 C ATOM 1463 C GLN A 95 -6.111 -2.016 10.670 1.00 0.00 C ATOM 1464 O GLN A 95 -5.208 -2.842 10.795 1.00 0.00 O ATOM 1465 CB GLN A 95 -8.047 -2.083 12.285 1.00 0.00 C ATOM 1466 CG GLN A 95 -9.513 -1.646 12.279 1.00 0.00 C ATOM 1467 CD GLN A 95 -9.910 -1.042 13.628 1.00 0.00 C ATOM 1468 OE1 GLN A 95 -10.483 -1.694 14.484 1.00 0.00 O ATOM 1469 NE2 GLN A 95 -9.574 0.238 13.767 1.00 0.00 N ATOM 0 H GLN A 95 -6.960 -4.430 10.889 1.00 0.00 H new ATOM 0 HA GLN A 95 -8.186 -1.863 10.169 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -7.925 -2.950 12.934 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -7.428 -1.286 12.698 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -9.675 -0.915 11.487 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -10.151 -2.502 12.058 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -9.095 0.725 13.009 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -9.796 0.732 14.631 1.00 0.00 H new ATOM 1478 N VAL A 96 -5.924 -0.741 10.361 1.00 0.00 N ATOM 1479 CA VAL A 96 -4.589 -0.212 10.141 1.00 0.00 C ATOM 1480 C VAL A 96 -4.440 1.112 10.893 1.00 0.00 C ATOM 1481 O VAL A 96 -4.885 2.154 10.416 1.00 0.00 O ATOM 1482 CB VAL A 96 -4.319 -0.082 8.641 1.00 0.00 C ATOM 1483 CG1 VAL A 96 -3.113 0.822 8.378 1.00 0.00 C ATOM 1484 CG2 VAL A 96 -4.125 -1.456 7.997 1.00 0.00 C ATOM 0 H VAL A 96 -6.675 -0.059 10.258 1.00 0.00 H new ATOM 0 HA VAL A 96 -3.837 -0.896 10.535 1.00 0.00 H new ATOM 0 HB VAL A 96 -5.192 0.382 8.182 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -2.942 0.898 7.304 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -3.306 1.814 8.786 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -2.230 0.399 8.857 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -3.935 -1.334 6.931 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -3.277 -1.959 8.462 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -5.025 -2.055 8.139 1.00 0.00 H new ATOM 1494 N ILE A 97 -3.811 1.027 12.056 1.00 0.00 N ATOM 1495 CA ILE A 97 -3.597 2.206 12.879 1.00 0.00 C ATOM 1496 C ILE A 97 -2.231 2.811 12.549 1.00 0.00 C ATOM 1497 O ILE A 97 -1.197 2.200 12.813 1.00 0.00 O ATOM 1498 CB ILE A 97 -3.779 1.866 14.359 1.00 0.00 C ATOM 1499 CG1 ILE A 97 -5.249 1.594 14.684 1.00 0.00 C ATOM 1500 CG2 ILE A 97 -3.188 2.961 15.250 1.00 0.00 C ATOM 1501 CD1 ILE A 97 -5.826 0.524 13.755 1.00 0.00 C ATOM 0 H ILE A 97 -3.443 0.160 12.448 1.00 0.00 H new ATOM 0 HA ILE A 97 -4.345 2.967 12.657 1.00 0.00 H new ATOM 0 HB ILE A 97 -3.229 0.948 14.568 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -5.342 1.270 15.720 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -5.824 2.515 14.585 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -3.331 2.694 16.297 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -2.123 3.063 15.043 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -3.689 3.907 15.045 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -6.872 0.349 14.007 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -5.753 0.862 12.721 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -5.264 -0.403 13.874 1.00 0.00 H new ATOM 1513 N CYS A 98 -2.271 4.006 11.978 1.00 0.00 N ATOM 1514 CA CYS A 98 -1.049 4.701 11.610 1.00 0.00 C ATOM 1515 C CYS A 98 -0.648 5.614 12.770 1.00 0.00 C ATOM 1516 O CYS A 98 -1.410 6.495 13.163 1.00 0.00 O ATOM 1517 CB CYS A 98 -1.213 5.478 10.302 1.00 0.00 C ATOM 1518 SG CYS A 98 0.280 6.488 9.983 1.00 0.00 S ATOM 0 H CYS A 98 -3.130 4.511 11.761 1.00 0.00 H new ATOM 0 HA CYS A 98 -0.255 3.976 11.429 1.00 0.00 H new ATOM 0 HB2 CYS A 98 -1.377 4.786 9.476 1.00 0.00 H new ATOM 0 HB3 CYS A 98 -2.092 6.121 10.359 1.00 0.00 H new ATOM 0 HG CYS A 98 0.981 5.939 9.036 1.00 0.00 H new ATOM 1524 N TYR A 99 0.548 5.371 13.285 1.00 0.00 N ATOM 1525 CA TYR A 99 1.060 6.161 14.392 1.00 0.00 C ATOM 1526 C TYR A 99 2.568 6.383 14.256 1.00 0.00 C ATOM 1527 O TYR A 99 3.200 5.841 13.351 1.00 0.00 O ATOM 1528 CB TYR A 99 0.790 5.341 15.655 1.00 0.00 C ATOM 1529 CG TYR A 99 1.644 4.077 15.771 1.00 0.00 C ATOM 1530 CD1 TYR A 99 1.353 2.974 14.994 1.00 0.00 C ATOM 1531 CD2 TYR A 99 2.705 4.039 16.653 1.00 0.00 C ATOM 1532 CE1 TYR A 99 2.157 1.784 15.104 1.00 0.00 C ATOM 1533 CE2 TYR A 99 3.508 2.850 16.762 1.00 0.00 C ATOM 1534 CZ TYR A 99 3.195 1.781 15.982 1.00 0.00 C ATOM 1535 OH TYR A 99 3.954 0.657 16.085 1.00 0.00 O ATOM 0 H TYR A 99 1.177 4.639 12.956 1.00 0.00 H new ATOM 0 HA TYR A 99 0.582 7.140 14.418 1.00 0.00 H new ATOM 0 HB2 TYR A 99 0.968 5.969 16.528 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -0.263 5.059 15.674 1.00 0.00 H new ATOM 0 HD1 TYR A 99 0.523 3.003 14.304 1.00 0.00 H new ATOM 0 HD2 TYR A 99 2.933 4.902 17.261 1.00 0.00 H new ATOM 0 HE1 TYR A 99 1.940 0.914 14.502 1.00 0.00 H new ATOM 0 HE2 TYR A 99 4.341 2.808 17.448 1.00 0.00 H new ATOM 0 HH TYR A 99 4.660 0.799 16.750 1.00 0.00 H new ATOM 1545 N GLU A 100 3.101 7.182 15.169 1.00 0.00 N ATOM 1546 CA GLU A 100 4.522 7.482 15.163 1.00 0.00 C ATOM 1547 C GLU A 100 5.111 7.296 16.563 1.00 0.00 C ATOM 1548 O GLU A 100 4.531 7.748 17.549 1.00 0.00 O ATOM 1549 CB GLU A 100 4.781 8.898 14.643 1.00 0.00 C ATOM 1550 CG GLU A 100 4.196 9.946 15.592 1.00 0.00 C ATOM 1551 CD GLU A 100 4.150 11.323 14.927 1.00 0.00 C ATOM 1552 OE1 GLU A 100 5.158 12.050 15.058 1.00 0.00 O ATOM 1553 OE2 GLU A 100 3.108 11.617 14.302 1.00 0.00 O ATOM 0 H GLU A 100 2.574 7.631 15.918 1.00 0.00 H new ATOM 0 HA GLU A 100 5.017 6.785 14.487 1.00 0.00 H new ATOM 0 HB2 GLU A 100 5.854 9.059 14.534 1.00 0.00 H new ATOM 0 HB3 GLU A 100 4.340 9.012 13.653 1.00 0.00 H new ATOM 0 HG2 GLU A 100 3.191 9.649 15.892 1.00 0.00 H new ATOM 0 HG3 GLU A 100 4.798 9.996 16.499 1.00 0.00 H new ATOM 1560 N GLU A 101 6.255 6.630 16.605 1.00 0.00 N ATOM 1561 CA GLU A 101 6.928 6.379 17.868 1.00 0.00 C ATOM 1562 C GLU A 101 7.763 7.594 18.275 1.00 0.00 C ATOM 1563 O GLU A 101 8.953 7.664 17.972 1.00 0.00 O ATOM 1564 CB GLU A 101 7.795 5.121 17.786 1.00 0.00 C ATOM 1565 CG GLU A 101 7.026 3.892 18.274 1.00 0.00 C ATOM 1566 CD GLU A 101 6.692 4.009 19.763 1.00 0.00 C ATOM 1567 OE1 GLU A 101 7.656 4.068 20.557 1.00 0.00 O ATOM 1568 OE2 GLU A 101 5.482 4.036 20.073 1.00 0.00 O ATOM 0 H GLU A 101 6.733 6.256 15.785 1.00 0.00 H new ATOM 0 HA GLU A 101 6.171 6.210 18.634 1.00 0.00 H new ATOM 0 HB2 GLU A 101 8.120 4.966 16.757 1.00 0.00 H new ATOM 0 HB3 GLU A 101 8.694 5.255 18.388 1.00 0.00 H new ATOM 0 HG2 GLU A 101 6.107 3.782 17.699 1.00 0.00 H new ATOM 0 HG3 GLU A 101 7.620 2.995 18.100 1.00 0.00 H new ATOM 1575 N ASN A 102 7.107 8.522 18.956 1.00 0.00 N ATOM 1576 CA ASN A 102 7.773 9.731 19.408 1.00 0.00 C ATOM 1577 C ASN A 102 6.972 10.352 20.554 1.00 0.00 C ATOM 1578 O ASN A 102 5.823 9.980 20.786 1.00 0.00 O ATOM 1579 CB ASN A 102 7.866 10.763 18.283 1.00 0.00 C ATOM 1580 CG ASN A 102 9.195 11.519 18.340 1.00 0.00 C ATOM 1581 OD1 ASN A 102 10.242 11.015 17.968 1.00 0.00 O ATOM 1582 ND2 ASN A 102 9.095 12.753 18.826 1.00 0.00 N ATOM 0 H ASN A 102 6.120 8.461 19.206 1.00 0.00 H new ATOM 0 HA ASN A 102 8.778 9.460 19.733 1.00 0.00 H new ATOM 0 HB2 ASN A 102 7.768 10.265 17.319 1.00 0.00 H new ATOM 0 HB3 ASN A 102 7.039 11.468 18.363 1.00 0.00 H new ATOM 0 HD21 ASN A 102 9.926 13.339 18.905 1.00 0.00 H new ATOM 0 HD22 ASN A 102 8.187 13.114 19.119 1.00 0.00 H new ATOM 1589 N LYS A 103 7.610 11.289 21.241 1.00 0.00 N ATOM 1590 CA LYS A 103 6.971 11.965 22.356 1.00 0.00 C ATOM 1591 C LYS A 103 7.161 13.476 22.208 1.00 0.00 C ATOM 1592 O LYS A 103 8.290 13.965 22.196 1.00 0.00 O ATOM 1593 CB LYS A 103 7.484 11.408 23.686 1.00 0.00 C ATOM 1594 CG LYS A 103 6.333 11.189 24.669 1.00 0.00 C ATOM 1595 CD LYS A 103 6.848 10.654 26.007 1.00 0.00 C ATOM 1596 CE LYS A 103 6.757 11.723 27.097 1.00 0.00 C ATOM 1597 NZ LYS A 103 6.423 11.108 28.400 1.00 0.00 N ATOM 0 H LYS A 103 8.563 11.595 21.046 1.00 0.00 H new ATOM 0 HA LYS A 103 5.897 11.776 22.351 1.00 0.00 H new ATOM 0 HB2 LYS A 103 8.004 10.466 23.513 1.00 0.00 H new ATOM 0 HB3 LYS A 103 8.209 12.098 24.118 1.00 0.00 H new ATOM 0 HG2 LYS A 103 5.803 12.128 24.829 1.00 0.00 H new ATOM 0 HG3 LYS A 103 5.616 10.486 24.244 1.00 0.00 H new ATOM 0 HD2 LYS A 103 6.267 9.780 26.301 1.00 0.00 H new ATOM 0 HD3 LYS A 103 7.882 10.328 25.898 1.00 0.00 H new ATOM 0 HE2 LYS A 103 7.705 12.256 27.172 1.00 0.00 H new ATOM 0 HE3 LYS A 103 5.998 12.459 26.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 6.365 11.848 29.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 5.507 10.620 28.329 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 7.161 10.423 28.660 1.00 0.00 H new ATOM 1611 N VAL A 104 6.040 14.174 22.099 1.00 0.00 N ATOM 1612 CA VAL A 104 6.070 15.619 21.953 1.00 0.00 C ATOM 1613 C VAL A 104 4.690 16.190 22.287 1.00 0.00 C ATOM 1614 O VAL A 104 3.670 15.640 21.874 1.00 0.00 O ATOM 1615 CB VAL A 104 6.546 15.993 20.547 1.00 0.00 C ATOM 1616 CG1 VAL A 104 5.817 15.169 19.484 1.00 0.00 C ATOM 1617 CG2 VAL A 104 6.377 17.491 20.291 1.00 0.00 C ATOM 0 H VAL A 104 5.105 13.765 22.109 1.00 0.00 H new ATOM 0 HA VAL A 104 6.782 16.058 22.651 1.00 0.00 H new ATOM 0 HB VAL A 104 7.609 15.760 20.480 1.00 0.00 H new ATOM 0 HG11 VAL A 104 6.174 15.454 18.494 1.00 0.00 H new ATOM 0 HG12 VAL A 104 6.012 14.109 19.648 1.00 0.00 H new ATOM 0 HG13 VAL A 104 4.745 15.355 19.551 1.00 0.00 H new ATOM 0 HG21 VAL A 104 6.723 17.730 19.285 1.00 0.00 H new ATOM 0 HG22 VAL A 104 5.325 17.760 20.386 1.00 0.00 H new ATOM 0 HG23 VAL A 104 6.963 18.053 21.019 1.00 0.00 H new ATOM 1627 N PRO A 105 4.703 17.314 23.053 1.00 0.00 N ATOM 1628 CA PRO A 105 3.466 17.965 23.448 1.00 0.00 C ATOM 1629 C PRO A 105 2.850 18.729 22.274 1.00 0.00 C ATOM 1630 O PRO A 105 3.567 19.235 21.413 1.00 0.00 O ATOM 1631 CB PRO A 105 3.849 18.867 24.609 1.00 0.00 C ATOM 1632 CG PRO A 105 5.357 19.041 24.521 1.00 0.00 C ATOM 1633 CD PRO A 105 5.892 17.992 23.560 1.00 0.00 C ATOM 0 HA PRO A 105 2.695 17.256 23.750 1.00 0.00 H new ATOM 0 HB2 PRO A 105 3.340 19.829 24.541 1.00 0.00 H new ATOM 0 HB3 PRO A 105 3.562 18.421 25.561 1.00 0.00 H new ATOM 0 HG2 PRO A 105 5.606 20.042 24.170 1.00 0.00 H new ATOM 0 HG3 PRO A 105 5.813 18.926 25.504 1.00 0.00 H new ATOM 0 HD2 PRO A 105 6.462 18.450 22.751 1.00 0.00 H new ATOM 0 HD3 PRO A 105 6.560 17.295 24.066 1.00 0.00 H new ATOM 1641 N THR A 106 1.526 18.789 22.278 1.00 0.00 N ATOM 1642 CA THR A 106 0.805 19.483 21.225 1.00 0.00 C ATOM 1643 C THR A 106 -0.075 20.585 21.818 1.00 0.00 C ATOM 1644 O THR A 106 -1.110 20.301 22.418 1.00 0.00 O ATOM 1645 CB THR A 106 0.019 18.442 20.424 1.00 0.00 C ATOM 1646 OG1 THR A 106 -1.082 18.115 21.268 1.00 0.00 O ATOM 1647 CG2 THR A 106 0.779 17.123 20.275 1.00 0.00 C ATOM 0 H THR A 106 0.934 18.368 22.994 1.00 0.00 H new ATOM 0 HA THR A 106 1.490 19.989 20.544 1.00 0.00 H new ATOM 0 HB THR A 106 -0.212 18.841 19.436 1.00 0.00 H new ATOM 0 HG1 THR A 106 -0.967 18.550 22.139 1.00 0.00 H new ATOM 0 HG21 THR A 106 0.178 16.420 19.699 1.00 0.00 H new ATOM 0 HG22 THR A 106 1.722 17.303 19.758 1.00 0.00 H new ATOM 0 HG23 THR A 106 0.980 16.706 21.262 1.00 0.00 H new ATOM 1655 N LYS A 107 0.369 21.819 21.628 1.00 0.00 N ATOM 1656 CA LYS A 107 -0.366 22.965 22.136 1.00 0.00 C ATOM 1657 C LYS A 107 -1.492 23.316 21.163 1.00 0.00 C ATOM 1658 O LYS A 107 -2.663 23.331 21.541 1.00 0.00 O ATOM 1659 CB LYS A 107 0.586 24.128 22.421 1.00 0.00 C ATOM 1660 CG LYS A 107 -0.134 25.258 23.160 1.00 0.00 C ATOM 1661 CD LYS A 107 0.710 26.534 23.167 1.00 0.00 C ATOM 1662 CE LYS A 107 0.678 27.205 24.541 1.00 0.00 C ATOM 1663 NZ LYS A 107 2.053 27.482 25.014 1.00 0.00 N ATOM 0 H LYS A 107 1.228 22.050 21.129 1.00 0.00 H new ATOM 0 HA LYS A 107 -0.834 22.725 23.091 1.00 0.00 H new ATOM 0 HB2 LYS A 107 1.427 23.776 23.018 1.00 0.00 H new ATOM 0 HB3 LYS A 107 0.996 24.505 21.484 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -1.094 25.455 22.683 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -0.344 24.951 24.185 1.00 0.00 H new ATOM 0 HD2 LYS A 107 1.739 26.295 22.899 1.00 0.00 H new ATOM 0 HD3 LYS A 107 0.336 27.226 22.412 1.00 0.00 H new ATOM 0 HE2 LYS A 107 0.112 28.135 24.485 1.00 0.00 H new ATOM 0 HE3 LYS A 107 0.164 26.561 25.255 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 2.014 27.938 25.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 2.582 26.589 25.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 2.531 28.114 24.341 1.00 0.00 H new ATOM 1677 N THR A 108 -1.100 23.590 19.927 1.00 0.00 N ATOM 1678 CA THR A 108 -2.062 23.940 18.896 1.00 0.00 C ATOM 1679 C THR A 108 -3.101 24.919 19.447 1.00 0.00 C ATOM 1680 O THR A 108 -4.204 24.517 19.814 1.00 0.00 O ATOM 1681 CB THR A 108 -2.673 22.644 18.360 1.00 0.00 C ATOM 1682 OG1 THR A 108 -1.584 21.986 17.717 1.00 0.00 O ATOM 1683 CG2 THR A 108 -3.676 22.892 17.232 1.00 0.00 C ATOM 0 H THR A 108 -0.129 23.577 19.616 1.00 0.00 H new ATOM 0 HA THR A 108 -1.581 24.457 18.066 1.00 0.00 H new ATOM 0 HB THR A 108 -3.166 22.112 19.174 1.00 0.00 H new ATOM 0 HG1 THR A 108 -1.892 21.134 17.342 1.00 0.00 H new ATOM 0 HG21 THR A 108 -4.080 21.940 16.888 1.00 0.00 H new ATOM 0 HG22 THR A 108 -4.489 23.519 17.599 1.00 0.00 H new ATOM 0 HG23 THR A 108 -3.176 23.394 16.404 1.00 0.00 H new ATOM 1691 N SER A 109 -2.711 26.184 19.487 1.00 0.00 N ATOM 1692 CA SER A 109 -3.595 27.224 19.987 1.00 0.00 C ATOM 1693 C SER A 109 -3.833 28.275 18.901 1.00 0.00 C ATOM 1694 O SER A 109 -3.200 29.330 18.904 1.00 0.00 O ATOM 1695 CB SER A 109 -3.019 27.880 21.243 1.00 0.00 C ATOM 1696 OG SER A 109 -3.973 27.938 22.300 1.00 0.00 O ATOM 0 H SER A 109 -1.795 26.513 19.182 1.00 0.00 H new ATOM 0 HA SER A 109 -4.547 26.764 20.254 1.00 0.00 H new ATOM 0 HB2 SER A 109 -2.144 27.322 21.575 1.00 0.00 H new ATOM 0 HB3 SER A 109 -2.682 28.888 21.003 1.00 0.00 H new ATOM 0 HG SER A 109 -3.567 28.362 23.085 1.00 0.00 H new ATOM 1702 N TRP A 110 -4.747 27.951 17.998 1.00 0.00 N ATOM 1703 CA TRP A 110 -5.076 28.854 16.908 1.00 0.00 C ATOM 1704 C TRP A 110 -6.595 29.031 16.883 1.00 0.00 C ATOM 1705 O TRP A 110 -7.333 28.152 17.326 1.00 0.00 O ATOM 1706 CB TRP A 110 -4.512 28.342 15.582 1.00 0.00 C ATOM 1707 CG TRP A 110 -4.131 29.449 14.598 1.00 0.00 C ATOM 1708 CD1 TRP A 110 -4.949 30.257 13.908 1.00 0.00 C ATOM 1709 CD2 TRP A 110 -2.795 29.841 14.219 1.00 0.00 C ATOM 1710 NE1 TRP A 110 -4.240 31.137 13.116 1.00 0.00 N ATOM 1711 CE2 TRP A 110 -2.888 30.876 13.311 1.00 0.00 C ATOM 1712 CE3 TRP A 110 -1.548 29.337 14.629 1.00 0.00 C ATOM 1713 CZ2 TRP A 110 -1.772 31.496 12.737 1.00 0.00 C ATOM 1714 CZ3 TRP A 110 -0.442 29.967 14.046 1.00 0.00 C ATOM 1715 CH2 TRP A 110 -0.519 31.010 13.131 1.00 0.00 C ATOM 0 H TRP A 110 -5.270 27.075 17.999 1.00 0.00 H new ATOM 0 HA TRP A 110 -4.614 29.829 17.063 1.00 0.00 H new ATOM 0 HB2 TRP A 110 -3.632 27.732 15.785 1.00 0.00 H new ATOM 0 HB3 TRP A 110 -5.250 27.691 15.113 1.00 0.00 H new ATOM 0 HD1 TRP A 110 -6.027 30.223 13.965 1.00 0.00 H new ATOM 0 HE1 TRP A 110 -4.635 31.848 12.501 1.00 0.00 H new ATOM 0 HE3 TRP A 110 -1.451 28.528 15.338 1.00 0.00 H new ATOM 0 HZ2 TRP A 110 -1.872 32.305 12.029 1.00 0.00 H new ATOM 0 HZ3 TRP A 110 0.540 29.618 14.327 1.00 0.00 H new ATOM 0 HH2 TRP A 110 0.383 31.444 12.726 1.00 0.00 H new ATOM 1726 N ASP A 111 -7.017 30.174 16.362 1.00 0.00 N ATOM 1727 CA ASP A 111 -8.436 30.477 16.273 1.00 0.00 C ATOM 1728 C ASP A 111 -8.668 31.482 15.144 1.00 0.00 C ATOM 1729 O ASP A 111 -7.883 32.412 14.963 1.00 0.00 O ATOM 1730 CB ASP A 111 -8.948 31.100 17.574 1.00 0.00 C ATOM 1731 CG ASP A 111 -8.504 32.544 17.817 1.00 0.00 C ATOM 1732 OD1 ASP A 111 -7.308 32.725 18.130 1.00 0.00 O ATOM 1733 OD2 ASP A 111 -9.372 33.434 17.686 1.00 0.00 O ATOM 0 H ASP A 111 -6.402 30.901 15.997 1.00 0.00 H new ATOM 0 HA ASP A 111 -8.969 29.545 16.085 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -10.037 31.066 17.572 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -8.612 30.487 18.410 1.00 0.00 H new ATOM 1738 N PRO A 112 -9.780 31.256 14.393 1.00 0.00 N ATOM 1739 CA PRO A 112 -10.126 32.131 13.286 1.00 0.00 C ATOM 1740 C PRO A 112 -10.696 33.458 13.793 1.00 0.00 C ATOM 1741 O PRO A 112 -11.253 33.520 14.887 1.00 0.00 O ATOM 1742 CB PRO A 112 -11.119 31.338 12.453 1.00 0.00 C ATOM 1743 CG PRO A 112 -11.645 30.241 13.364 1.00 0.00 C ATOM 1744 CD PRO A 112 -10.733 30.166 14.578 1.00 0.00 C ATOM 0 HA PRO A 112 -9.260 32.414 12.687 1.00 0.00 H new ATOM 0 HB2 PRO A 112 -11.930 31.975 12.101 1.00 0.00 H new ATOM 0 HB3 PRO A 112 -10.639 30.916 11.570 1.00 0.00 H new ATOM 0 HG2 PRO A 112 -12.669 30.456 13.669 1.00 0.00 H new ATOM 0 HG3 PRO A 112 -11.662 29.285 12.840 1.00 0.00 H new ATOM 0 HD2 PRO A 112 -11.296 30.285 15.504 1.00 0.00 H new ATOM 0 HD3 PRO A 112 -10.227 29.202 14.634 1.00 0.00 H new ATOM 1752 N GLY A 113 -10.536 34.486 12.972 1.00 0.00 N ATOM 1753 CA GLY A 113 -11.028 35.807 13.324 1.00 0.00 C ATOM 1754 C GLY A 113 -10.062 36.895 12.850 1.00 0.00 C ATOM 1755 O GLY A 113 -8.850 36.768 13.012 1.00 0.00 O ATOM 0 H GLY A 113 -10.073 34.431 12.065 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -12.009 35.965 12.875 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -11.157 35.875 14.404 1.00 0.00 H new ATOM 1759 N PHE A 114 -10.637 37.941 12.273 1.00 0.00 N ATOM 1760 CA PHE A 114 -9.842 39.051 11.775 1.00 0.00 C ATOM 1761 C PHE A 114 -8.748 38.559 10.825 1.00 0.00 C ATOM 1762 O PHE A 114 -8.579 37.355 10.637 1.00 0.00 O ATOM 1763 CB PHE A 114 -9.188 39.713 12.989 1.00 0.00 C ATOM 1764 CG PHE A 114 -10.128 40.619 13.786 1.00 0.00 C ATOM 1765 CD1 PHE A 114 -11.321 40.140 14.229 1.00 0.00 C ATOM 1766 CD2 PHE A 114 -9.771 41.904 14.051 1.00 0.00 C ATOM 1767 CE1 PHE A 114 -12.194 40.981 14.968 1.00 0.00 C ATOM 1768 CE2 PHE A 114 -10.644 42.746 14.791 1.00 0.00 C ATOM 1769 CZ PHE A 114 -11.837 42.266 15.234 1.00 0.00 C ATOM 0 H PHE A 114 -11.643 38.043 12.140 1.00 0.00 H new ATOM 0 HA PHE A 114 -10.477 39.746 11.226 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -8.802 38.936 13.649 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -8.333 40.300 12.653 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -11.605 39.119 14.019 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -8.824 42.285 13.699 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -13.142 40.600 15.319 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -10.360 43.767 15.002 1.00 0.00 H new ATOM 0 HZ PHE A 114 -12.501 42.905 15.797 1.00 0.00 H new ATOM 1779 N SER A 115 -8.033 39.515 10.252 1.00 0.00 N ATOM 1780 CA SER A 115 -6.959 39.194 9.326 1.00 0.00 C ATOM 1781 C SER A 115 -7.521 38.458 8.109 1.00 0.00 C ATOM 1782 O SER A 115 -8.006 37.334 8.227 1.00 0.00 O ATOM 1783 CB SER A 115 -5.880 38.349 10.006 1.00 0.00 C ATOM 1784 OG SER A 115 -4.850 39.154 10.574 1.00 0.00 O ATOM 0 H SER A 115 -8.176 40.512 10.410 1.00 0.00 H new ATOM 0 HA SER A 115 -6.499 40.126 8.998 1.00 0.00 H new ATOM 0 HB2 SER A 115 -6.335 37.739 10.786 1.00 0.00 H new ATOM 0 HB3 SER A 115 -5.445 37.663 9.279 1.00 0.00 H new ATOM 0 HG SER A 115 -4.182 38.578 11.000 1.00 0.00 H new ATOM 1790 N GLY A 116 -7.437 39.122 6.965 1.00 0.00 N ATOM 1791 CA GLY A 116 -7.931 38.545 5.727 1.00 0.00 C ATOM 1792 C GLY A 116 -7.022 38.908 4.551 1.00 0.00 C ATOM 1793 O GLY A 116 -5.857 39.251 4.746 1.00 0.00 O ATOM 0 H GLY A 116 -7.034 40.054 6.870 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -7.989 37.461 5.825 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -8.942 38.902 5.533 1.00 0.00 H new ATOM 1797 N PRO A 117 -7.604 38.819 3.325 1.00 0.00 N ATOM 1798 CA PRO A 117 -6.859 39.134 2.118 1.00 0.00 C ATOM 1799 C PRO A 117 -6.682 40.646 1.962 1.00 0.00 C ATOM 1800 O PRO A 117 -7.400 41.426 2.586 1.00 0.00 O ATOM 1801 CB PRO A 117 -7.659 38.510 0.987 1.00 0.00 C ATOM 1802 CG PRO A 117 -9.053 38.272 1.545 1.00 0.00 C ATOM 1803 CD PRO A 117 -8.981 38.416 3.056 1.00 0.00 C ATOM 0 HA PRO A 117 -5.844 38.738 2.135 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -7.692 39.171 0.121 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -7.205 37.575 0.657 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -9.759 38.989 1.126 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -9.409 37.278 1.273 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -9.689 39.162 3.417 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -9.224 37.478 3.555 1.00 0.00 H new ATOM 1811 N SER A 118 -5.722 41.014 1.126 1.00 0.00 N ATOM 1812 CA SER A 118 -5.442 42.418 0.881 1.00 0.00 C ATOM 1813 C SER A 118 -4.412 42.558 -0.242 1.00 0.00 C ATOM 1814 O SER A 118 -3.599 41.660 -0.458 1.00 0.00 O ATOM 1815 CB SER A 118 -4.941 43.111 2.150 1.00 0.00 C ATOM 1816 OG SER A 118 -4.528 44.451 1.899 1.00 0.00 O ATOM 0 H SER A 118 -5.129 40.364 0.610 1.00 0.00 H new ATOM 0 HA SER A 118 -6.370 42.903 0.578 1.00 0.00 H new ATOM 0 HB2 SER A 118 -5.732 43.110 2.900 1.00 0.00 H new ATOM 0 HB3 SER A 118 -4.107 42.546 2.566 1.00 0.00 H new ATOM 0 HG SER A 118 -4.217 44.859 2.734 1.00 0.00 H new ATOM 1822 N SER A 119 -4.479 43.690 -0.926 1.00 0.00 N ATOM 1823 CA SER A 119 -3.562 43.959 -2.021 1.00 0.00 C ATOM 1824 C SER A 119 -3.172 45.438 -2.026 1.00 0.00 C ATOM 1825 O SER A 119 -3.939 46.288 -1.576 1.00 0.00 O ATOM 1826 CB SER A 119 -4.180 43.568 -3.365 1.00 0.00 C ATOM 1827 OG SER A 119 -4.472 42.175 -3.434 1.00 0.00 O ATOM 0 H SER A 119 -5.154 44.432 -0.743 1.00 0.00 H new ATOM 0 HA SER A 119 -2.667 43.355 -1.874 1.00 0.00 H new ATOM 0 HB2 SER A 119 -5.095 44.138 -3.523 1.00 0.00 H new ATOM 0 HB3 SER A 119 -3.495 43.835 -4.170 1.00 0.00 H new ATOM 0 HG SER A 119 -4.866 41.966 -4.306 1.00 0.00 H new ATOM 1833 N GLY A 120 -1.979 45.701 -2.540 1.00 0.00 N ATOM 1834 CA GLY A 120 -1.478 47.063 -2.609 1.00 0.00 C ATOM 1835 C GLY A 120 -1.097 47.579 -1.220 1.00 0.00 C ATOM 1836 O GLY A 120 -0.069 47.189 -0.670 1.00 0.00 O ATOM 0 H GLY A 120 -1.345 44.994 -2.912 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -0.609 47.102 -3.266 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -2.237 47.712 -3.046 1.00 0.00 H new TER 1840 GLY A 120