USER MOD reduce.3.24.130724 H: found=0, std=0, add=929, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 925 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 15 ASN : amide:sc= -0.799 K(o=-0.8,f=-2.9!) USER MOD Set 1.2: A 119 SER OG : rot 85:sc= 0.00348 USER MOD Set 2.1: A 53 SER OG : rot -150:sc= -0.0695 USER MOD Set 2.2: A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 40 HIS : no HD1:sc= -3.8 K(o=-9.8,f=-15!) USER MOD Set 3.2: A 60 MET CE :methyl -156:sc= -5.98! (180deg=-6.4!) USER MOD Single : A 1 GLY N :NH3+ -117:sc= 0.128 (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 GLN : amide:sc= 0 K(o=0,f=-0.88) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 ASN : amide:sc= -1.37 K(o=-1.4,f=-2.6!) USER MOD Single : A 13 SER OG : rot 39:sc= 0.531 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 ASN : amide:sc= -0.43 K(o=-0.43,f=-3!) USER MOD Single : A 22 TYR OH : rot -68:sc= 0.128 USER MOD Single : A 23 THR OG1 : rot 42:sc= 0.321 USER MOD Single : A 25 SER OG : rot 180:sc= -0.41 USER MOD Single : A 26 GLN : amide:sc= -0.0143 X(o=-0.014,f=-0.39) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot 180:sc= -0.0464 USER MOD Single : A 39 LYS NZ :NH3+ 178:sc= 0.00681 (180deg=0.00654) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 GLN : amide:sc= -0.893 K(o=-0.89,f=-1.4) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 1:sc= 0.642 USER MOD Single : A 55 SER OG : rot 180:sc= -0.445 USER MOD Single : A 64 ASN : amide:sc= -0.0372 X(o=-0.037,f=-0.44) USER MOD Single : A 70 MET CE :methyl -119:sc= -0.095 (180deg=-1.62) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 THR OG1 : rot -138:sc= 0.703 USER MOD Single : A 76 HIS : no HE2:sc= -4.36! C(o=-4.4!,f=-13!) USER MOD Single : A 79 ASN : amide:sc= -0.277 K(o=-0.28,f=-1.1) USER MOD Single : A 80 THR OG1 : rot 180:sc= -0.148 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 36:sc= 1.05 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 CYS SG : rot 180:sc= -0.0249 USER MOD Single : A 96 ASN : amide:sc= -0.906 K(o=-0.91,f=-3.9) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ -124:sc= 0.172 (180deg=0.0212) USER MOD Single : A 103 TYR OH : rot 180:sc= 0 USER MOD Single : A 106 ASN : amide:sc= -7.83! C(o=-7.8!,f=-4.4!) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -10.692 -3.017 24.251 1.00 0.00 N ATOM 2 CA GLY A 1 -9.587 -3.456 23.415 1.00 0.00 C ATOM 3 C GLY A 1 -8.746 -2.266 22.949 1.00 0.00 C ATOM 4 O GLY A 1 -8.999 -1.129 23.345 1.00 0.00 O ATOM 0 H1 GLY A 1 -10.583 -3.414 25.206 1.00 0.00 H new ATOM 0 H2 GLY A 1 -10.695 -1.978 24.306 1.00 0.00 H new ATOM 0 H3 GLY A 1 -11.590 -3.344 23.840 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -8.960 -4.153 23.971 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -9.973 -3.995 22.549 1.00 0.00 H new ATOM 8 N SER A 2 -7.763 -2.568 22.114 1.00 0.00 N ATOM 9 CA SER A 2 -6.883 -1.537 21.590 1.00 0.00 C ATOM 10 C SER A 2 -6.069 -2.090 20.418 1.00 0.00 C ATOM 11 O SER A 2 -6.135 -1.563 19.309 1.00 0.00 O ATOM 12 CB SER A 2 -5.950 -1.003 22.679 1.00 0.00 C ATOM 13 OG SER A 2 -4.929 -0.166 22.143 1.00 0.00 O ATOM 0 H SER A 2 -7.556 -3.512 21.787 1.00 0.00 H new ATOM 0 HA SER A 2 -7.498 -0.709 21.238 1.00 0.00 H new ATOM 0 HB2 SER A 2 -6.531 -0.443 23.412 1.00 0.00 H new ATOM 0 HB3 SER A 2 -5.493 -1.840 23.207 1.00 0.00 H new ATOM 0 HG SER A 2 -4.355 0.156 22.869 1.00 0.00 H new ATOM 19 N SER A 3 -5.321 -3.145 20.705 1.00 0.00 N ATOM 20 CA SER A 3 -4.495 -3.776 19.688 1.00 0.00 C ATOM 21 C SER A 3 -4.390 -5.278 19.958 1.00 0.00 C ATOM 22 O SER A 3 -4.263 -5.699 21.106 1.00 0.00 O ATOM 23 CB SER A 3 -3.102 -3.145 19.642 1.00 0.00 C ATOM 24 OG SER A 3 -2.654 -2.939 18.305 1.00 0.00 O ATOM 0 H SER A 3 -5.269 -3.579 21.627 1.00 0.00 H new ATOM 0 HA SER A 3 -4.967 -3.620 18.718 1.00 0.00 H new ATOM 0 HB2 SER A 3 -3.118 -2.192 20.170 1.00 0.00 H new ATOM 0 HB3 SER A 3 -2.395 -3.788 20.166 1.00 0.00 H new ATOM 0 HG SER A 3 -1.762 -2.533 18.318 1.00 0.00 H new ATOM 30 N GLY A 4 -4.445 -6.045 18.879 1.00 0.00 N ATOM 31 CA GLY A 4 -4.357 -7.492 18.984 1.00 0.00 C ATOM 32 C GLY A 4 -3.576 -8.081 17.808 1.00 0.00 C ATOM 33 O GLY A 4 -2.965 -7.346 17.034 1.00 0.00 O ATOM 0 H GLY A 4 -4.549 -5.692 17.928 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -3.870 -7.763 19.921 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -5.359 -7.920 19.010 1.00 0.00 H new ATOM 37 N SER A 5 -3.622 -9.402 17.710 1.00 0.00 N ATOM 38 CA SER A 5 -2.927 -10.098 16.641 1.00 0.00 C ATOM 39 C SER A 5 -1.442 -9.731 16.658 1.00 0.00 C ATOM 40 O SER A 5 -1.063 -8.640 16.235 1.00 0.00 O ATOM 41 CB SER A 5 -3.540 -9.767 15.279 1.00 0.00 C ATOM 42 OG SER A 5 -4.836 -10.339 15.124 1.00 0.00 O ATOM 0 H SER A 5 -4.130 -10.008 18.354 1.00 0.00 H new ATOM 0 HA SER A 5 -3.032 -11.170 16.805 1.00 0.00 H new ATOM 0 HB2 SER A 5 -3.605 -8.685 15.164 1.00 0.00 H new ATOM 0 HB3 SER A 5 -2.885 -10.133 14.488 1.00 0.00 H new ATOM 0 HG SER A 5 -5.194 -10.104 14.243 1.00 0.00 H new ATOM 48 N SER A 6 -0.640 -10.664 17.151 1.00 0.00 N ATOM 49 CA SER A 6 0.795 -10.453 17.229 1.00 0.00 C ATOM 50 C SER A 6 1.441 -10.743 15.872 1.00 0.00 C ATOM 51 O SER A 6 0.882 -11.477 15.059 1.00 0.00 O ATOM 52 CB SER A 6 1.423 -11.331 18.314 1.00 0.00 C ATOM 53 OG SER A 6 2.597 -10.740 18.865 1.00 0.00 O ATOM 0 H SER A 6 -0.958 -11.568 17.500 1.00 0.00 H new ATOM 0 HA SER A 6 0.973 -9.411 17.494 1.00 0.00 H new ATOM 0 HB2 SER A 6 0.696 -11.502 19.108 1.00 0.00 H new ATOM 0 HB3 SER A 6 1.671 -12.306 17.894 1.00 0.00 H new ATOM 0 HG SER A 6 2.967 -11.330 19.555 1.00 0.00 H new ATOM 59 N GLY A 7 2.609 -10.151 15.670 1.00 0.00 N ATOM 60 CA GLY A 7 3.336 -10.336 14.426 1.00 0.00 C ATOM 61 C GLY A 7 2.888 -9.321 13.373 1.00 0.00 C ATOM 62 O GLY A 7 1.717 -9.284 13.000 1.00 0.00 O ATOM 0 H GLY A 7 3.070 -9.543 16.347 1.00 0.00 H new ATOM 0 HA2 GLY A 7 4.406 -10.230 14.607 1.00 0.00 H new ATOM 0 HA3 GLY A 7 3.174 -11.347 14.053 1.00 0.00 H new ATOM 66 N GLN A 8 3.845 -8.523 12.922 1.00 0.00 N ATOM 67 CA GLN A 8 3.564 -7.510 11.919 1.00 0.00 C ATOM 68 C GLN A 8 4.863 -7.033 11.267 1.00 0.00 C ATOM 69 O GLN A 8 5.838 -6.741 11.958 1.00 0.00 O ATOM 70 CB GLN A 8 2.792 -6.337 12.526 1.00 0.00 C ATOM 71 CG GLN A 8 3.650 -5.585 13.545 1.00 0.00 C ATOM 72 CD GLN A 8 2.900 -4.374 14.106 1.00 0.00 C ATOM 73 OE1 GLN A 8 1.710 -4.201 13.904 1.00 0.00 O ATOM 74 NE2 GLN A 8 3.662 -3.550 14.820 1.00 0.00 N ATOM 0 H GLN A 8 4.816 -8.558 13.233 1.00 0.00 H new ATOM 0 HA GLN A 8 2.936 -7.955 11.147 1.00 0.00 H new ATOM 0 HB2 GLN A 8 2.479 -5.655 11.735 1.00 0.00 H new ATOM 0 HB3 GLN A 8 1.886 -6.704 13.008 1.00 0.00 H new ATOM 0 HG2 GLN A 8 3.926 -6.256 14.359 1.00 0.00 H new ATOM 0 HG3 GLN A 8 4.577 -5.257 13.074 1.00 0.00 H new ATOM 0 HE21 GLN A 8 4.653 -3.755 14.950 1.00 0.00 H new ATOM 0 HE22 GLN A 8 3.256 -2.713 15.238 1.00 0.00 H new ATOM 83 N LYS A 9 4.835 -6.970 9.944 1.00 0.00 N ATOM 84 CA LYS A 9 5.999 -6.533 9.191 1.00 0.00 C ATOM 85 C LYS A 9 5.590 -6.259 7.742 1.00 0.00 C ATOM 86 O LYS A 9 4.539 -6.714 7.293 1.00 0.00 O ATOM 87 CB LYS A 9 7.137 -7.547 9.328 1.00 0.00 C ATOM 88 CG LYS A 9 6.771 -8.875 8.661 1.00 0.00 C ATOM 89 CD LYS A 9 5.989 -9.774 9.622 1.00 0.00 C ATOM 90 CE LYS A 9 5.762 -11.159 9.014 1.00 0.00 C ATOM 91 NZ LYS A 9 5.214 -12.087 10.029 1.00 0.00 N ATOM 0 H LYS A 9 4.025 -7.214 9.374 1.00 0.00 H new ATOM 0 HA LYS A 9 6.386 -5.598 9.596 1.00 0.00 H new ATOM 0 HB2 LYS A 9 8.043 -7.146 8.874 1.00 0.00 H new ATOM 0 HB3 LYS A 9 7.355 -7.714 10.383 1.00 0.00 H new ATOM 0 HG2 LYS A 9 6.175 -8.686 7.768 1.00 0.00 H new ATOM 0 HG3 LYS A 9 7.678 -9.385 8.337 1.00 0.00 H new ATOM 0 HD2 LYS A 9 6.534 -9.870 10.561 1.00 0.00 H new ATOM 0 HD3 LYS A 9 5.029 -9.314 9.856 1.00 0.00 H new ATOM 0 HE2 LYS A 9 5.074 -11.085 8.172 1.00 0.00 H new ATOM 0 HE3 LYS A 9 6.702 -11.550 8.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 5.066 -13.023 9.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 5.884 -12.171 10.820 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 4.307 -11.720 10.381 1.00 0.00 H new ATOM 105 N ASN A 10 6.443 -5.517 7.051 1.00 0.00 N ATOM 106 CA ASN A 10 6.184 -5.177 5.662 1.00 0.00 C ATOM 107 C ASN A 10 7.356 -4.361 5.114 1.00 0.00 C ATOM 108 O ASN A 10 8.003 -3.622 5.855 1.00 0.00 O ATOM 109 CB ASN A 10 4.916 -4.332 5.529 1.00 0.00 C ATOM 110 CG ASN A 10 5.003 -3.073 6.395 1.00 0.00 C ATOM 111 OD1 ASN A 10 5.934 -2.290 6.306 1.00 0.00 O ATOM 112 ND2 ASN A 10 3.983 -2.924 7.236 1.00 0.00 N ATOM 0 H ASN A 10 7.314 -5.142 7.427 1.00 0.00 H new ATOM 0 HA ASN A 10 6.058 -6.106 5.105 1.00 0.00 H new ATOM 0 HB2 ASN A 10 4.770 -4.051 4.486 1.00 0.00 H new ATOM 0 HB3 ASN A 10 4.049 -4.922 5.825 1.00 0.00 H new ATOM 0 HD21 ASN A 10 3.948 -2.116 7.858 1.00 0.00 H new ATOM 0 HD22 ASN A 10 3.236 -3.618 7.259 1.00 0.00 H new ATOM 119 N PRO A 11 7.601 -4.526 3.786 1.00 0.00 N ATOM 120 CA PRO A 11 8.684 -3.813 3.131 1.00 0.00 C ATOM 121 C PRO A 11 8.321 -2.342 2.916 1.00 0.00 C ATOM 122 O PRO A 11 9.142 -1.457 3.149 1.00 0.00 O ATOM 123 CB PRO A 11 8.917 -4.563 1.829 1.00 0.00 C ATOM 124 CG PRO A 11 7.658 -5.380 1.587 1.00 0.00 C ATOM 125 CD PRO A 11 6.856 -5.393 2.878 1.00 0.00 C ATOM 0 HA PRO A 11 9.594 -3.788 3.730 1.00 0.00 H new ATOM 0 HB2 PRO A 11 9.097 -3.871 1.007 1.00 0.00 H new ATOM 0 HB3 PRO A 11 9.793 -5.208 1.901 1.00 0.00 H new ATOM 0 HG2 PRO A 11 7.071 -4.946 0.777 1.00 0.00 H new ATOM 0 HG3 PRO A 11 7.914 -6.396 1.286 1.00 0.00 H new ATOM 0 HD2 PRO A 11 5.843 -5.023 2.719 1.00 0.00 H new ATOM 0 HD3 PRO A 11 6.767 -6.403 3.279 1.00 0.00 H new ATOM 133 N ASP A 12 7.090 -2.128 2.475 1.00 0.00 N ATOM 134 CA ASP A 12 6.609 -0.779 2.227 1.00 0.00 C ATOM 135 C ASP A 12 5.079 -0.779 2.235 1.00 0.00 C ATOM 136 O ASP A 12 4.459 0.010 2.946 1.00 0.00 O ATOM 137 CB ASP A 12 7.074 -0.271 0.861 1.00 0.00 C ATOM 138 CG ASP A 12 8.121 0.843 0.907 1.00 0.00 C ATOM 139 OD1 ASP A 12 8.329 1.380 2.017 1.00 0.00 O ATOM 140 OD2 ASP A 12 8.691 1.133 -0.167 1.00 0.00 O ATOM 0 H ASP A 12 6.412 -2.865 2.283 1.00 0.00 H new ATOM 0 HA ASP A 12 7.006 -0.130 3.008 1.00 0.00 H new ATOM 0 HB2 ASP A 12 7.483 -1.110 0.298 1.00 0.00 H new ATOM 0 HB3 ASP A 12 6.206 0.090 0.310 1.00 0.00 H new ATOM 145 N SER A 13 4.514 -1.673 1.437 1.00 0.00 N ATOM 146 CA SER A 13 3.069 -1.786 1.343 1.00 0.00 C ATOM 147 C SER A 13 2.676 -3.228 1.016 1.00 0.00 C ATOM 148 O SER A 13 2.855 -3.682 -0.113 1.00 0.00 O ATOM 149 CB SER A 13 2.509 -0.830 0.287 1.00 0.00 C ATOM 150 OG SER A 13 3.097 -1.045 -0.993 1.00 0.00 O ATOM 0 H SER A 13 5.032 -2.326 0.849 1.00 0.00 H new ATOM 0 HA SER A 13 2.641 -1.510 2.307 1.00 0.00 H new ATOM 0 HB2 SER A 13 1.429 -0.960 0.216 1.00 0.00 H new ATOM 0 HB3 SER A 13 2.686 0.199 0.599 1.00 0.00 H new ATOM 0 HG SER A 13 3.221 -2.006 -1.139 1.00 0.00 H new ATOM 156 N TYR A 14 2.149 -3.907 2.024 1.00 0.00 N ATOM 157 CA TYR A 14 1.730 -5.289 1.857 1.00 0.00 C ATOM 158 C TYR A 14 0.648 -5.660 2.873 1.00 0.00 C ATOM 159 O TYR A 14 0.950 -5.943 4.031 1.00 0.00 O ATOM 160 CB TYR A 14 2.973 -6.141 2.120 1.00 0.00 C ATOM 161 CG TYR A 14 2.940 -7.514 1.446 1.00 0.00 C ATOM 162 CD1 TYR A 14 2.749 -7.610 0.083 1.00 0.00 C ATOM 163 CD2 TYR A 14 3.100 -8.658 2.203 1.00 0.00 C ATOM 164 CE1 TYR A 14 2.717 -8.903 -0.551 1.00 0.00 C ATOM 165 CE2 TYR A 14 3.068 -9.951 1.569 1.00 0.00 C ATOM 166 CZ TYR A 14 2.878 -10.009 0.224 1.00 0.00 C ATOM 167 OH TYR A 14 2.848 -11.230 -0.375 1.00 0.00 O ATOM 0 H TYR A 14 2.002 -3.527 2.959 1.00 0.00 H new ATOM 0 HA TYR A 14 1.318 -5.447 0.861 1.00 0.00 H new ATOM 0 HB2 TYR A 14 3.853 -5.599 1.774 1.00 0.00 H new ATOM 0 HB3 TYR A 14 3.086 -6.278 3.195 1.00 0.00 H new ATOM 0 HD1 TYR A 14 2.623 -6.715 -0.509 1.00 0.00 H new ATOM 0 HD2 TYR A 14 3.249 -8.583 3.270 1.00 0.00 H new ATOM 0 HE1 TYR A 14 2.569 -8.992 -1.617 1.00 0.00 H new ATOM 0 HE2 TYR A 14 3.192 -10.854 2.149 1.00 0.00 H new ATOM 0 HH TYR A 14 2.977 -11.929 0.300 1.00 0.00 H new ATOM 177 N ASN A 15 -0.590 -5.645 2.402 1.00 0.00 N ATOM 178 CA ASN A 15 -1.719 -5.977 3.255 1.00 0.00 C ATOM 179 C ASN A 15 -2.993 -6.032 2.410 1.00 0.00 C ATOM 180 O ASN A 15 -3.672 -7.057 2.370 1.00 0.00 O ATOM 181 CB ASN A 15 -1.918 -4.918 4.341 1.00 0.00 C ATOM 182 CG ASN A 15 -2.620 -5.512 5.564 1.00 0.00 C ATOM 183 OD1 ASN A 15 -2.015 -6.153 6.409 1.00 0.00 O ATOM 184 ND2 ASN A 15 -3.925 -5.264 5.613 1.00 0.00 N ATOM 0 H ASN A 15 -0.836 -5.408 1.441 1.00 0.00 H new ATOM 0 HA ASN A 15 -1.516 -6.940 3.723 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -0.952 -4.508 4.635 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -2.508 -4.092 3.944 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -4.482 -5.617 6.391 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -4.369 -4.721 4.873 1.00 0.00 H new ATOM 191 N GLY A 16 -3.279 -4.917 1.754 1.00 0.00 N ATOM 192 CA GLY A 16 -4.459 -4.826 0.911 1.00 0.00 C ATOM 193 C GLY A 16 -4.111 -4.237 -0.457 1.00 0.00 C ATOM 194 O GLY A 16 -3.030 -4.487 -0.988 1.00 0.00 O ATOM 0 H GLY A 16 -2.714 -4.069 1.789 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -4.897 -5.816 0.784 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -5.211 -4.205 1.398 1.00 0.00 H new ATOM 198 N ALA A 17 -5.049 -3.466 -0.989 1.00 0.00 N ATOM 199 CA ALA A 17 -4.855 -2.840 -2.286 1.00 0.00 C ATOM 200 C ALA A 17 -3.867 -1.680 -2.145 1.00 0.00 C ATOM 201 O ALA A 17 -4.141 -0.708 -1.444 1.00 0.00 O ATOM 202 CB ALA A 17 -6.207 -2.389 -2.842 1.00 0.00 C ATOM 0 H ALA A 17 -5.944 -3.261 -0.546 1.00 0.00 H new ATOM 0 HA ALA A 17 -4.431 -3.550 -2.995 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -6.062 -1.919 -3.815 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -6.862 -3.253 -2.950 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -6.661 -1.673 -2.157 1.00 0.00 H new ATOM 208 N VAL A 18 -2.737 -1.822 -2.822 1.00 0.00 N ATOM 209 CA VAL A 18 -1.706 -0.799 -2.781 1.00 0.00 C ATOM 210 C VAL A 18 -1.864 0.126 -3.990 1.00 0.00 C ATOM 211 O VAL A 18 -2.827 0.008 -4.745 1.00 0.00 O ATOM 212 CB VAL A 18 -0.324 -1.450 -2.704 1.00 0.00 C ATOM 213 CG1 VAL A 18 -0.208 -2.344 -1.467 1.00 0.00 C ATOM 214 CG2 VAL A 18 -0.017 -2.237 -3.980 1.00 0.00 C ATOM 0 H VAL A 18 -2.513 -2.630 -3.402 1.00 0.00 H new ATOM 0 HA VAL A 18 -1.812 -0.186 -1.886 1.00 0.00 H new ATOM 0 HB VAL A 18 0.417 -0.655 -2.614 1.00 0.00 H new ATOM 0 HG11 VAL A 18 0.784 -2.795 -1.436 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -0.363 -1.745 -0.569 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -0.962 -3.129 -1.514 1.00 0.00 H new ATOM 0 HG21 VAL A 18 0.971 -2.690 -3.899 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -0.765 -3.019 -4.114 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -0.039 -1.564 -4.837 1.00 0.00 H new ATOM 224 N ARG A 19 -0.903 1.027 -4.134 1.00 0.00 N ATOM 225 CA ARG A 19 -0.923 1.972 -5.238 1.00 0.00 C ATOM 226 C ARG A 19 0.211 2.988 -5.088 1.00 0.00 C ATOM 227 O ARG A 19 0.648 3.276 -3.975 1.00 0.00 O ATOM 228 CB ARG A 19 -2.259 2.716 -5.302 1.00 0.00 C ATOM 229 CG ARG A 19 -3.132 2.177 -6.438 1.00 0.00 C ATOM 230 CD ARG A 19 -3.014 3.057 -7.684 1.00 0.00 C ATOM 231 NE ARG A 19 -4.357 3.314 -8.251 1.00 0.00 N ATOM 232 CZ ARG A 19 -5.237 4.182 -7.734 1.00 0.00 C ATOM 233 NH1 ARG A 19 -4.921 4.882 -6.636 1.00 0.00 N ATOM 234 NH2 ARG A 19 -6.433 4.351 -8.315 1.00 0.00 N ATOM 0 H ARG A 19 -0.106 1.123 -3.505 1.00 0.00 H new ATOM 0 HA ARG A 19 -0.790 1.407 -6.160 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -2.784 2.610 -4.353 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -2.080 3.781 -5.450 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -2.833 1.157 -6.679 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -4.172 2.136 -6.114 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -2.531 4.000 -7.429 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -2.384 2.567 -8.427 1.00 0.00 H new ATOM 0 HE ARG A 19 -4.630 2.798 -9.088 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -4.011 4.754 -6.194 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -5.591 5.543 -6.242 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -6.674 3.819 -9.151 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -7.103 5.012 -7.921 1.00 0.00 H new ATOM 248 N GLU A 20 0.655 3.503 -6.225 1.00 0.00 N ATOM 249 CA GLU A 20 1.730 4.481 -6.234 1.00 0.00 C ATOM 250 C GLU A 20 1.257 5.796 -5.613 1.00 0.00 C ATOM 251 O GLU A 20 2.017 6.467 -4.916 1.00 0.00 O ATOM 252 CB GLU A 20 2.258 4.703 -7.653 1.00 0.00 C ATOM 253 CG GLU A 20 1.158 5.247 -8.567 1.00 0.00 C ATOM 254 CD GLU A 20 1.326 4.727 -9.996 1.00 0.00 C ATOM 255 OE1 GLU A 20 1.204 3.495 -10.169 1.00 0.00 O ATOM 256 OE2 GLU A 20 1.573 5.573 -10.883 1.00 0.00 O ATOM 0 H GLU A 20 0.290 3.262 -7.146 1.00 0.00 H new ATOM 0 HA GLU A 20 2.552 4.093 -5.632 1.00 0.00 H new ATOM 0 HB2 GLU A 20 3.094 5.401 -7.629 1.00 0.00 H new ATOM 0 HB3 GLU A 20 2.638 3.764 -8.055 1.00 0.00 H new ATOM 0 HG2 GLU A 20 0.182 4.953 -8.182 1.00 0.00 H new ATOM 0 HG3 GLU A 20 1.186 6.337 -8.567 1.00 0.00 H new ATOM 263 N ASN A 21 0.003 6.126 -5.887 1.00 0.00 N ATOM 264 CA ASN A 21 -0.581 7.349 -5.364 1.00 0.00 C ATOM 265 C ASN A 21 -0.437 7.367 -3.841 1.00 0.00 C ATOM 266 O ASN A 21 0.228 8.241 -3.287 1.00 0.00 O ATOM 267 CB ASN A 21 -2.071 7.435 -5.699 1.00 0.00 C ATOM 268 CG ASN A 21 -2.487 8.880 -5.981 1.00 0.00 C ATOM 269 OD1 ASN A 21 -1.690 9.718 -6.371 1.00 0.00 O ATOM 270 ND2 ASN A 21 -3.776 9.124 -5.764 1.00 0.00 N ATOM 0 H ASN A 21 -0.625 5.567 -6.465 1.00 0.00 H new ATOM 0 HA ASN A 21 -0.060 8.192 -5.818 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -2.288 6.814 -6.568 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -2.657 7.039 -4.870 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -4.152 10.059 -5.924 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -4.389 8.377 -5.438 1.00 0.00 H new ATOM 277 N TYR A 22 -1.071 6.391 -3.207 1.00 0.00 N ATOM 278 CA TYR A 22 -1.022 6.284 -1.759 1.00 0.00 C ATOM 279 C TYR A 22 -1.426 4.882 -1.299 1.00 0.00 C ATOM 280 O TYR A 22 -2.483 4.381 -1.679 1.00 0.00 O ATOM 281 CB TYR A 22 -2.038 7.296 -1.226 1.00 0.00 C ATOM 282 CG TYR A 22 -3.474 7.038 -1.689 1.00 0.00 C ATOM 283 CD1 TYR A 22 -4.261 6.123 -1.021 1.00 0.00 C ATOM 284 CD2 TYR A 22 -3.981 7.721 -2.776 1.00 0.00 C ATOM 285 CE1 TYR A 22 -5.611 5.880 -1.456 1.00 0.00 C ATOM 286 CE2 TYR A 22 -5.332 7.479 -3.211 1.00 0.00 C ATOM 287 CZ TYR A 22 -6.080 6.570 -2.530 1.00 0.00 C ATOM 288 OH TYR A 22 -7.356 6.342 -2.942 1.00 0.00 O ATOM 0 H TYR A 22 -1.621 5.667 -3.670 1.00 0.00 H new ATOM 0 HA TYR A 22 -0.013 6.474 -1.394 1.00 0.00 H new ATOM 0 HB2 TYR A 22 -2.011 7.284 -0.136 1.00 0.00 H new ATOM 0 HB3 TYR A 22 -1.739 8.296 -1.541 1.00 0.00 H new ATOM 0 HD1 TYR A 22 -3.864 5.589 -0.171 1.00 0.00 H new ATOM 0 HD2 TYR A 22 -3.365 8.437 -3.300 1.00 0.00 H new ATOM 0 HE1 TYR A 22 -6.237 5.166 -0.941 1.00 0.00 H new ATOM 0 HE2 TYR A 22 -5.742 8.007 -4.059 1.00 0.00 H new ATOM 0 HH TYR A 22 -7.423 5.438 -3.315 1.00 0.00 H new ATOM 298 N THR A 23 -0.564 4.289 -0.487 1.00 0.00 N ATOM 299 CA THR A 23 -0.818 2.954 0.029 1.00 0.00 C ATOM 300 C THR A 23 -1.662 3.027 1.303 1.00 0.00 C ATOM 301 O THR A 23 -1.606 4.015 2.034 1.00 0.00 O ATOM 302 CB THR A 23 0.531 2.261 0.233 1.00 0.00 C ATOM 303 OG1 THR A 23 1.379 3.292 0.732 1.00 0.00 O ATOM 304 CG2 THR A 23 1.183 1.849 -1.089 1.00 0.00 C ATOM 0 H THR A 23 0.311 4.708 -0.173 1.00 0.00 H new ATOM 0 HA THR A 23 -1.401 2.361 -0.676 1.00 0.00 H new ATOM 0 HB THR A 23 0.396 1.380 0.861 1.00 0.00 H new ATOM 0 HG1 THR A 23 0.891 3.824 1.395 1.00 0.00 H new ATOM 0 HG21 THR A 23 2.137 1.362 -0.888 1.00 0.00 H new ATOM 0 HG22 THR A 23 0.527 1.158 -1.618 1.00 0.00 H new ATOM 0 HG23 THR A 23 1.350 2.734 -1.704 1.00 0.00 H new ATOM 312 N TRP A 24 -2.425 1.968 1.531 1.00 0.00 N ATOM 313 CA TRP A 24 -3.279 1.899 2.704 1.00 0.00 C ATOM 314 C TRP A 24 -3.589 0.426 2.978 1.00 0.00 C ATOM 315 O TRP A 24 -3.305 -0.437 2.148 1.00 0.00 O ATOM 316 CB TRP A 24 -4.537 2.749 2.517 1.00 0.00 C ATOM 317 CG TRP A 24 -5.681 2.021 1.808 1.00 0.00 C ATOM 318 CD1 TRP A 24 -5.938 1.970 0.494 1.00 0.00 C ATOM 319 CD2 TRP A 24 -6.718 1.236 2.433 1.00 0.00 C ATOM 320 NE1 TRP A 24 -7.061 1.213 0.227 1.00 0.00 N ATOM 321 CE2 TRP A 24 -7.550 0.753 1.443 1.00 0.00 C ATOM 322 CE3 TRP A 24 -6.946 0.944 3.789 1.00 0.00 C ATOM 323 CZ2 TRP A 24 -8.666 -0.051 1.705 1.00 0.00 C ATOM 324 CZ3 TRP A 24 -8.066 0.140 4.034 1.00 0.00 C ATOM 325 CH2 TRP A 24 -8.913 -0.355 3.049 1.00 0.00 C ATOM 0 H TRP A 24 -2.469 1.150 0.923 1.00 0.00 H new ATOM 0 HA TRP A 24 -2.772 2.316 3.574 1.00 0.00 H new ATOM 0 HB2 TRP A 24 -4.884 3.085 3.494 1.00 0.00 H new ATOM 0 HB3 TRP A 24 -4.279 3.641 1.946 1.00 0.00 H new ATOM 0 HD1 TRP A 24 -5.341 2.460 -0.261 1.00 0.00 H new ATOM 0 HE1 TRP A 24 -7.458 1.026 -0.694 1.00 0.00 H new ATOM 0 HE3 TRP A 24 -6.308 1.311 4.579 1.00 0.00 H new ATOM 0 HZ2 TRP A 24 -9.302 -0.417 0.913 1.00 0.00 H new ATOM 0 HZ3 TRP A 24 -8.287 -0.113 5.060 1.00 0.00 H new ATOM 0 HH2 TRP A 24 -9.758 -0.971 3.319 1.00 0.00 H new ATOM 336 N SER A 25 -4.167 0.183 4.145 1.00 0.00 N ATOM 337 CA SER A 25 -4.519 -1.171 4.538 1.00 0.00 C ATOM 338 C SER A 25 -5.686 -1.143 5.527 1.00 0.00 C ATOM 339 O SER A 25 -5.872 -0.162 6.245 1.00 0.00 O ATOM 340 CB SER A 25 -3.319 -1.895 5.154 1.00 0.00 C ATOM 341 OG SER A 25 -2.146 -1.757 4.357 1.00 0.00 O ATOM 0 H SER A 25 -4.400 0.901 4.831 1.00 0.00 H new ATOM 0 HA SER A 25 -4.821 -1.718 3.645 1.00 0.00 H new ATOM 0 HB2 SER A 25 -3.129 -1.498 6.151 1.00 0.00 H new ATOM 0 HB3 SER A 25 -3.555 -2.953 5.272 1.00 0.00 H new ATOM 0 HG SER A 25 -1.402 -2.231 4.784 1.00 0.00 H new ATOM 347 N GLN A 26 -6.442 -2.231 5.532 1.00 0.00 N ATOM 348 CA GLN A 26 -7.586 -2.343 6.421 1.00 0.00 C ATOM 349 C GLN A 26 -7.293 -3.345 7.540 1.00 0.00 C ATOM 350 O GLN A 26 -6.862 -4.466 7.277 1.00 0.00 O ATOM 351 CB GLN A 26 -8.845 -2.739 5.647 1.00 0.00 C ATOM 352 CG GLN A 26 -9.978 -3.121 6.601 1.00 0.00 C ATOM 353 CD GLN A 26 -11.209 -3.597 5.828 1.00 0.00 C ATOM 354 OE1 GLN A 26 -11.732 -2.915 4.961 1.00 0.00 O ATOM 355 NE2 GLN A 26 -11.641 -4.802 6.188 1.00 0.00 N ATOM 0 H GLN A 26 -6.285 -3.043 4.935 1.00 0.00 H new ATOM 0 HA GLN A 26 -7.768 -1.367 6.872 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -9.162 -1.911 5.013 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -8.622 -3.578 4.987 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -9.641 -3.908 7.275 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -10.242 -2.263 7.220 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -11.157 -5.319 6.921 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -12.457 -5.209 5.731 1.00 0.00 H new ATOM 364 N ASP A 27 -7.538 -2.903 8.765 1.00 0.00 N ATOM 365 CA ASP A 27 -7.306 -3.747 9.925 1.00 0.00 C ATOM 366 C ASP A 27 -8.524 -3.683 10.849 1.00 0.00 C ATOM 367 O ASP A 27 -9.485 -2.969 10.566 1.00 0.00 O ATOM 368 CB ASP A 27 -6.086 -3.271 10.716 1.00 0.00 C ATOM 369 CG ASP A 27 -4.862 -2.919 9.869 1.00 0.00 C ATOM 370 OD1 ASP A 27 -4.695 -3.571 8.815 1.00 0.00 O ATOM 371 OD2 ASP A 27 -4.122 -2.007 10.293 1.00 0.00 O ATOM 0 H ASP A 27 -7.895 -1.972 8.979 1.00 0.00 H new ATOM 0 HA ASP A 27 -7.134 -4.764 9.574 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -6.369 -2.395 11.299 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -5.806 -4.049 11.426 1.00 0.00 H new ATOM 376 N TYR A 28 -8.443 -4.438 11.934 1.00 0.00 N ATOM 377 CA TYR A 28 -9.527 -4.475 12.902 1.00 0.00 C ATOM 378 C TYR A 28 -9.275 -3.491 14.046 1.00 0.00 C ATOM 379 O TYR A 28 -9.464 -3.829 15.213 1.00 0.00 O ATOM 380 CB TYR A 28 -9.542 -5.898 13.463 1.00 0.00 C ATOM 381 CG TYR A 28 -10.945 -6.476 13.657 1.00 0.00 C ATOM 382 CD1 TYR A 28 -11.616 -7.032 12.588 1.00 0.00 C ATOM 383 CD2 TYR A 28 -11.539 -6.442 14.903 1.00 0.00 C ATOM 384 CE1 TYR A 28 -12.937 -7.576 12.770 1.00 0.00 C ATOM 385 CE2 TYR A 28 -12.860 -6.986 15.085 1.00 0.00 C ATOM 386 CZ TYR A 28 -13.493 -7.526 14.010 1.00 0.00 C ATOM 387 OH TYR A 28 -14.741 -8.040 14.183 1.00 0.00 O ATOM 0 H TYR A 28 -7.644 -5.029 12.165 1.00 0.00 H new ATOM 0 HA TYR A 28 -10.471 -4.201 12.432 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -8.982 -6.548 12.791 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -9.022 -5.905 14.421 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -11.151 -7.059 11.614 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -11.013 -6.008 15.741 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -13.474 -8.013 11.941 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -13.337 -6.965 16.054 1.00 0.00 H new ATOM 0 HH TYR A 28 -15.010 -7.937 15.120 1.00 0.00 H new ATOM 397 N THR A 29 -8.854 -2.292 13.670 1.00 0.00 N ATOM 398 CA THR A 29 -8.574 -1.256 14.650 1.00 0.00 C ATOM 399 C THR A 29 -8.734 0.129 14.021 1.00 0.00 C ATOM 400 O THR A 29 -9.501 0.954 14.515 1.00 0.00 O ATOM 401 CB THR A 29 -7.177 -1.508 15.219 1.00 0.00 C ATOM 402 OG1 THR A 29 -6.344 -1.602 14.066 1.00 0.00 O ATOM 403 CG2 THR A 29 -7.053 -2.882 15.881 1.00 0.00 C ATOM 0 H THR A 29 -8.700 -2.015 12.700 1.00 0.00 H new ATOM 0 HA THR A 29 -9.286 -1.288 15.475 1.00 0.00 H new ATOM 0 HB THR A 29 -6.936 -0.732 15.946 1.00 0.00 H new ATOM 0 HG1 THR A 29 -5.418 -1.763 14.344 1.00 0.00 H new ATOM 0 HG21 THR A 29 -6.042 -3.010 16.268 1.00 0.00 H new ATOM 0 HG22 THR A 29 -7.767 -2.957 16.701 1.00 0.00 H new ATOM 0 HG23 THR A 29 -7.261 -3.660 15.146 1.00 0.00 H new ATOM 411 N ASP A 30 -7.997 0.342 12.941 1.00 0.00 N ATOM 412 CA ASP A 30 -8.047 1.614 12.240 1.00 0.00 C ATOM 413 C ASP A 30 -7.425 1.451 10.851 1.00 0.00 C ATOM 414 O ASP A 30 -6.837 0.414 10.549 1.00 0.00 O ATOM 415 CB ASP A 30 -7.255 2.688 12.989 1.00 0.00 C ATOM 416 CG ASP A 30 -7.580 2.809 14.479 1.00 0.00 C ATOM 417 OD1 ASP A 30 -8.593 3.473 14.787 1.00 0.00 O ATOM 418 OD2 ASP A 30 -6.807 2.234 15.277 1.00 0.00 O ATOM 0 H ASP A 30 -7.362 -0.345 12.534 1.00 0.00 H new ATOM 0 HA ASP A 30 -9.091 1.919 12.170 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -6.191 2.476 12.880 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -7.438 3.651 12.513 1.00 0.00 H new ATOM 423 N LEU A 31 -7.577 2.490 10.044 1.00 0.00 N ATOM 424 CA LEU A 31 -7.038 2.475 8.695 1.00 0.00 C ATOM 425 C LEU A 31 -5.675 3.170 8.687 1.00 0.00 C ATOM 426 O LEU A 31 -5.534 4.272 9.215 1.00 0.00 O ATOM 427 CB LEU A 31 -8.042 3.077 7.710 1.00 0.00 C ATOM 428 CG LEU A 31 -9.445 2.467 7.724 1.00 0.00 C ATOM 429 CD1 LEU A 31 -10.433 3.380 8.453 1.00 0.00 C ATOM 430 CD2 LEU A 31 -9.912 2.133 6.306 1.00 0.00 C ATOM 0 H LEU A 31 -8.066 3.348 10.298 1.00 0.00 H new ATOM 0 HA LEU A 31 -6.875 1.450 8.361 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -8.129 4.144 7.917 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -7.636 2.980 6.703 1.00 0.00 H new ATOM 0 HG LEU A 31 -9.404 1.529 8.279 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -11.422 2.923 8.448 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -10.104 3.523 9.482 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -10.477 4.345 7.948 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -10.912 1.701 6.345 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -9.933 3.043 5.706 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -9.224 1.417 5.856 1.00 0.00 H new ATOM 442 N GLU A 32 -4.707 2.498 8.082 1.00 0.00 N ATOM 443 CA GLU A 32 -3.361 3.038 7.999 1.00 0.00 C ATOM 444 C GLU A 32 -2.987 3.307 6.540 1.00 0.00 C ATOM 445 O GLU A 32 -2.931 2.384 5.728 1.00 0.00 O ATOM 446 CB GLU A 32 -2.351 2.097 8.659 1.00 0.00 C ATOM 447 CG GLU A 32 -1.737 2.739 9.905 1.00 0.00 C ATOM 448 CD GLU A 32 -1.175 1.674 10.849 1.00 0.00 C ATOM 449 OE1 GLU A 32 -1.999 0.910 11.397 1.00 0.00 O ATOM 450 OE2 GLU A 32 0.065 1.649 11.002 1.00 0.00 O ATOM 0 H GLU A 32 -4.828 1.585 7.645 1.00 0.00 H new ATOM 0 HA GLU A 32 -3.335 3.983 8.541 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -2.843 1.163 8.931 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -1.563 1.847 7.948 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -0.943 3.425 9.611 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -2.492 3.329 10.424 1.00 0.00 H new ATOM 457 N VAL A 33 -2.739 4.577 6.250 1.00 0.00 N ATOM 458 CA VAL A 33 -2.372 4.979 4.903 1.00 0.00 C ATOM 459 C VAL A 33 -1.087 5.808 4.956 1.00 0.00 C ATOM 460 O VAL A 33 -0.964 6.719 5.773 1.00 0.00 O ATOM 461 CB VAL A 33 -3.535 5.722 4.244 1.00 0.00 C ATOM 462 CG1 VAL A 33 -4.333 6.520 5.277 1.00 0.00 C ATOM 463 CG2 VAL A 33 -3.038 6.628 3.116 1.00 0.00 C ATOM 0 H VAL A 33 -2.785 5.340 6.925 1.00 0.00 H new ATOM 0 HA VAL A 33 -2.170 4.104 4.285 1.00 0.00 H new ATOM 0 HB VAL A 33 -4.202 4.979 3.808 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -5.154 7.038 4.781 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -4.734 5.842 6.030 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -3.680 7.249 5.757 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -3.885 7.145 2.664 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -2.339 7.361 3.519 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -2.535 6.025 2.360 1.00 0.00 H new ATOM 473 N ARG A 34 -0.161 5.462 4.074 1.00 0.00 N ATOM 474 CA ARG A 34 1.111 6.162 4.009 1.00 0.00 C ATOM 475 C ARG A 34 1.368 6.664 2.587 1.00 0.00 C ATOM 476 O ARG A 34 1.184 5.926 1.621 1.00 0.00 O ATOM 477 CB ARG A 34 2.263 5.251 4.438 1.00 0.00 C ATOM 478 CG ARG A 34 2.205 4.963 5.939 1.00 0.00 C ATOM 479 CD ARG A 34 2.517 3.493 6.228 1.00 0.00 C ATOM 480 NE ARG A 34 3.916 3.190 5.853 1.00 0.00 N ATOM 481 CZ ARG A 34 4.987 3.628 6.529 1.00 0.00 C ATOM 482 NH1 ARG A 34 4.825 4.391 7.618 1.00 0.00 N ATOM 483 NH2 ARG A 34 6.219 3.303 6.115 1.00 0.00 N ATOM 0 H ARG A 34 -0.266 4.706 3.398 1.00 0.00 H new ATOM 0 HA ARG A 34 1.059 7.009 4.693 1.00 0.00 H new ATOM 0 HB2 ARG A 34 2.217 4.314 3.882 1.00 0.00 H new ATOM 0 HB3 ARG A 34 3.215 5.722 4.191 1.00 0.00 H new ATOM 0 HG2 ARG A 34 2.918 5.600 6.463 1.00 0.00 H new ATOM 0 HG3 ARG A 34 1.215 5.211 6.322 1.00 0.00 H new ATOM 0 HD2 ARG A 34 2.361 3.281 7.286 1.00 0.00 H new ATOM 0 HD3 ARG A 34 1.835 2.851 5.670 1.00 0.00 H new ATOM 0 HE ARG A 34 4.075 2.611 5.028 1.00 0.00 H new ATOM 0 HH11 ARG A 34 3.887 4.638 7.932 1.00 0.00 H new ATOM 0 HH12 ARG A 34 5.640 4.725 8.133 1.00 0.00 H new ATOM 0 HH21 ARG A 34 6.342 2.722 5.285 1.00 0.00 H new ATOM 0 HH22 ARG A 34 7.034 3.636 6.629 1.00 0.00 H new ATOM 497 N VAL A 35 1.791 7.917 2.504 1.00 0.00 N ATOM 498 CA VAL A 35 2.076 8.527 1.217 1.00 0.00 C ATOM 499 C VAL A 35 3.581 8.777 1.097 1.00 0.00 C ATOM 500 O VAL A 35 4.210 9.260 2.037 1.00 0.00 O ATOM 501 CB VAL A 35 1.244 9.800 1.045 1.00 0.00 C ATOM 502 CG1 VAL A 35 1.427 10.390 -0.355 1.00 0.00 C ATOM 503 CG2 VAL A 35 -0.234 9.532 1.338 1.00 0.00 C ATOM 0 H VAL A 35 1.943 8.526 3.308 1.00 0.00 H new ATOM 0 HA VAL A 35 1.792 7.856 0.406 1.00 0.00 H new ATOM 0 HB VAL A 35 1.601 10.534 1.767 1.00 0.00 H new ATOM 0 HG11 VAL A 35 0.825 11.294 -0.451 1.00 0.00 H new ATOM 0 HG12 VAL A 35 2.477 10.635 -0.512 1.00 0.00 H new ATOM 0 HG13 VAL A 35 1.109 9.662 -1.101 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -0.803 10.452 1.209 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -0.609 8.774 0.651 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -0.343 9.179 2.363 1.00 0.00 H new ATOM 513 N PRO A 36 4.128 8.427 -0.098 1.00 0.00 N ATOM 514 CA PRO A 36 5.547 8.608 -0.352 1.00 0.00 C ATOM 515 C PRO A 36 5.877 10.082 -0.593 1.00 0.00 C ATOM 516 O PRO A 36 5.117 10.793 -1.249 1.00 0.00 O ATOM 517 CB PRO A 36 5.846 7.728 -1.555 1.00 0.00 C ATOM 518 CG PRO A 36 4.504 7.451 -2.213 1.00 0.00 C ATOM 519 CD PRO A 36 3.413 7.852 -1.233 1.00 0.00 C ATOM 0 HA PRO A 36 6.167 8.322 0.498 1.00 0.00 H new ATOM 0 HB2 PRO A 36 6.524 8.229 -2.246 1.00 0.00 H new ATOM 0 HB3 PRO A 36 6.330 6.800 -1.250 1.00 0.00 H new ATOM 0 HG2 PRO A 36 4.410 8.015 -3.141 1.00 0.00 H new ATOM 0 HG3 PRO A 36 4.416 6.396 -2.471 1.00 0.00 H new ATOM 0 HD2 PRO A 36 2.728 8.574 -1.677 1.00 0.00 H new ATOM 0 HD3 PRO A 36 2.816 6.991 -0.930 1.00 0.00 H new ATOM 527 N VAL A 37 7.012 10.498 -0.050 1.00 0.00 N ATOM 528 CA VAL A 37 7.452 11.875 -0.197 1.00 0.00 C ATOM 529 C VAL A 37 8.880 11.893 -0.746 1.00 0.00 C ATOM 530 O VAL A 37 9.607 10.908 -0.629 1.00 0.00 O ATOM 531 CB VAL A 37 7.315 12.614 1.135 1.00 0.00 C ATOM 532 CG1 VAL A 37 5.866 12.593 1.627 1.00 0.00 C ATOM 533 CG2 VAL A 37 8.259 12.029 2.187 1.00 0.00 C ATOM 0 H VAL A 37 7.640 9.905 0.493 1.00 0.00 H new ATOM 0 HA VAL A 37 6.821 12.403 -0.912 1.00 0.00 H new ATOM 0 HB VAL A 37 7.599 13.654 0.972 1.00 0.00 H new ATOM 0 HG11 VAL A 37 5.796 13.125 2.576 1.00 0.00 H new ATOM 0 HG12 VAL A 37 5.225 13.078 0.891 1.00 0.00 H new ATOM 0 HG13 VAL A 37 5.544 11.561 1.765 1.00 0.00 H new ATOM 0 HG21 VAL A 37 8.141 12.573 3.124 1.00 0.00 H new ATOM 0 HG22 VAL A 37 8.020 10.977 2.345 1.00 0.00 H new ATOM 0 HG23 VAL A 37 9.289 12.119 1.842 1.00 0.00 H new ATOM 543 N PRO A 38 9.249 13.055 -1.350 1.00 0.00 N ATOM 544 CA PRO A 38 10.577 13.215 -1.917 1.00 0.00 C ATOM 545 C PRO A 38 11.623 13.413 -0.818 1.00 0.00 C ATOM 546 O PRO A 38 11.284 13.470 0.363 1.00 0.00 O ATOM 547 CB PRO A 38 10.465 14.408 -2.852 1.00 0.00 C ATOM 548 CG PRO A 38 9.212 15.155 -2.425 1.00 0.00 C ATOM 549 CD PRO A 38 8.415 14.243 -1.507 1.00 0.00 C ATOM 0 HA PRO A 38 10.911 12.331 -2.459 1.00 0.00 H new ATOM 0 HB2 PRO A 38 11.345 15.047 -2.778 1.00 0.00 H new ATOM 0 HB3 PRO A 38 10.393 14.085 -3.891 1.00 0.00 H new ATOM 0 HG2 PRO A 38 9.475 16.079 -1.910 1.00 0.00 H new ATOM 0 HG3 PRO A 38 8.618 15.433 -3.296 1.00 0.00 H new ATOM 0 HD2 PRO A 38 8.220 14.720 -0.546 1.00 0.00 H new ATOM 0 HD3 PRO A 38 7.447 13.993 -1.941 1.00 0.00 H new ATOM 557 N LYS A 39 12.873 13.511 -1.246 1.00 0.00 N ATOM 558 CA LYS A 39 13.971 13.702 -0.313 1.00 0.00 C ATOM 559 C LYS A 39 14.141 15.196 -0.031 1.00 0.00 C ATOM 560 O LYS A 39 15.150 15.613 0.537 1.00 0.00 O ATOM 561 CB LYS A 39 15.240 13.025 -0.834 1.00 0.00 C ATOM 562 CG LYS A 39 14.934 11.628 -1.377 1.00 0.00 C ATOM 563 CD LYS A 39 15.033 10.576 -0.271 1.00 0.00 C ATOM 564 CE LYS A 39 14.053 9.427 -0.518 1.00 0.00 C ATOM 565 NZ LYS A 39 13.898 8.606 0.704 1.00 0.00 N ATOM 0 H LYS A 39 13.150 13.462 -2.226 1.00 0.00 H new ATOM 0 HA LYS A 39 13.750 13.221 0.640 1.00 0.00 H new ATOM 0 HB2 LYS A 39 15.685 13.635 -1.620 1.00 0.00 H new ATOM 0 HB3 LYS A 39 15.974 12.954 -0.031 1.00 0.00 H new ATOM 0 HG2 LYS A 39 13.934 11.613 -1.809 1.00 0.00 H new ATOM 0 HG3 LYS A 39 15.631 11.385 -2.179 1.00 0.00 H new ATOM 0 HD2 LYS A 39 16.050 10.187 -0.224 1.00 0.00 H new ATOM 0 HD3 LYS A 39 14.823 11.037 0.694 1.00 0.00 H new ATOM 0 HE2 LYS A 39 13.085 9.826 -0.821 1.00 0.00 H new ATOM 0 HE3 LYS A 39 14.412 8.805 -1.338 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 13.204 7.851 0.529 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 14.814 8.183 0.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 13.567 9.206 1.486 1.00 0.00 H new ATOM 579 N HIS A 40 13.140 15.961 -0.441 1.00 0.00 N ATOM 580 CA HIS A 40 13.167 17.399 -0.239 1.00 0.00 C ATOM 581 C HIS A 40 12.053 17.803 0.729 1.00 0.00 C ATOM 582 O HIS A 40 11.929 18.974 1.085 1.00 0.00 O ATOM 583 CB HIS A 40 13.085 18.137 -1.577 1.00 0.00 C ATOM 584 CG HIS A 40 11.690 18.218 -2.149 1.00 0.00 C ATOM 585 ND1 HIS A 40 11.327 17.597 -3.332 1.00 0.00 N ATOM 586 CD2 HIS A 40 10.573 18.852 -1.689 1.00 0.00 C ATOM 587 CE1 HIS A 40 10.048 17.853 -3.564 1.00 0.00 C ATOM 588 NE2 HIS A 40 9.583 18.632 -2.545 1.00 0.00 N ATOM 0 H HIS A 40 12.305 15.612 -0.912 1.00 0.00 H new ATOM 0 HA HIS A 40 14.116 17.688 0.213 1.00 0.00 H new ATOM 0 HB2 HIS A 40 13.473 19.147 -1.447 1.00 0.00 H new ATOM 0 HB3 HIS A 40 13.733 17.637 -2.297 1.00 0.00 H new ATOM 0 HD2 HIS A 40 10.506 19.434 -0.782 1.00 0.00 H new ATOM 0 HE1 HIS A 40 9.474 17.506 -4.411 1.00 0.00 H new ATOM 0 HE2 HIS A 40 8.631 18.987 -2.456 1.00 0.00 H new ATOM 596 N VAL A 41 11.271 16.810 1.128 1.00 0.00 N ATOM 597 CA VAL A 41 10.172 17.047 2.048 1.00 0.00 C ATOM 598 C VAL A 41 10.571 16.568 3.446 1.00 0.00 C ATOM 599 O VAL A 41 10.733 15.370 3.673 1.00 0.00 O ATOM 600 CB VAL A 41 8.900 16.376 1.527 1.00 0.00 C ATOM 601 CG1 VAL A 41 7.857 16.240 2.638 1.00 0.00 C ATOM 602 CG2 VAL A 41 8.329 17.138 0.329 1.00 0.00 C ATOM 0 H VAL A 41 11.377 15.840 0.831 1.00 0.00 H new ATOM 0 HA VAL A 41 9.956 18.113 2.119 1.00 0.00 H new ATOM 0 HB VAL A 41 9.164 15.373 1.191 1.00 0.00 H new ATOM 0 HG11 VAL A 41 6.963 15.760 2.241 1.00 0.00 H new ATOM 0 HG12 VAL A 41 8.265 15.635 3.448 1.00 0.00 H new ATOM 0 HG13 VAL A 41 7.600 17.229 3.018 1.00 0.00 H new ATOM 0 HG21 VAL A 41 7.425 16.640 -0.022 1.00 0.00 H new ATOM 0 HG22 VAL A 41 8.088 18.158 0.628 1.00 0.00 H new ATOM 0 HG23 VAL A 41 9.066 17.159 -0.474 1.00 0.00 H new ATOM 612 N VAL A 42 10.717 17.529 4.346 1.00 0.00 N ATOM 613 CA VAL A 42 11.093 17.221 5.715 1.00 0.00 C ATOM 614 C VAL A 42 10.152 17.952 6.675 1.00 0.00 C ATOM 615 O VAL A 42 9.721 17.386 7.679 1.00 0.00 O ATOM 616 CB VAL A 42 12.566 17.566 5.943 1.00 0.00 C ATOM 617 CG1 VAL A 42 13.478 16.632 5.145 1.00 0.00 C ATOM 618 CG2 VAL A 42 12.846 19.031 5.600 1.00 0.00 C ATOM 0 H VAL A 42 10.582 18.522 4.154 1.00 0.00 H new ATOM 0 HA VAL A 42 10.989 16.153 5.909 1.00 0.00 H new ATOM 0 HB VAL A 42 12.783 17.423 7.001 1.00 0.00 H new ATOM 0 HG11 VAL A 42 14.519 16.899 5.325 1.00 0.00 H new ATOM 0 HG12 VAL A 42 13.308 15.602 5.459 1.00 0.00 H new ATOM 0 HG13 VAL A 42 13.257 16.729 4.082 1.00 0.00 H new ATOM 0 HG21 VAL A 42 13.900 19.250 5.771 1.00 0.00 H new ATOM 0 HG22 VAL A 42 12.603 19.212 4.553 1.00 0.00 H new ATOM 0 HG23 VAL A 42 12.235 19.676 6.231 1.00 0.00 H new ATOM 628 N LYS A 43 9.861 19.199 6.333 1.00 0.00 N ATOM 629 CA LYS A 43 8.979 20.013 7.152 1.00 0.00 C ATOM 630 C LYS A 43 7.529 19.592 6.906 1.00 0.00 C ATOM 631 O LYS A 43 7.202 19.072 5.840 1.00 0.00 O ATOM 632 CB LYS A 43 9.239 21.500 6.904 1.00 0.00 C ATOM 633 CG LYS A 43 10.566 21.937 7.527 1.00 0.00 C ATOM 634 CD LYS A 43 10.338 22.948 8.652 1.00 0.00 C ATOM 635 CE LYS A 43 11.270 22.674 9.834 1.00 0.00 C ATOM 636 NZ LYS A 43 11.974 23.912 10.236 1.00 0.00 N ATOM 0 H LYS A 43 10.220 19.665 5.500 1.00 0.00 H new ATOM 0 HA LYS A 43 9.183 19.850 8.210 1.00 0.00 H new ATOM 0 HB2 LYS A 43 9.255 21.696 5.832 1.00 0.00 H new ATOM 0 HB3 LYS A 43 8.424 22.090 7.324 1.00 0.00 H new ATOM 0 HG2 LYS A 43 11.093 21.066 7.917 1.00 0.00 H new ATOM 0 HG3 LYS A 43 11.204 22.378 6.761 1.00 0.00 H new ATOM 0 HD2 LYS A 43 10.507 23.958 8.278 1.00 0.00 H new ATOM 0 HD3 LYS A 43 9.301 22.900 8.984 1.00 0.00 H new ATOM 0 HE2 LYS A 43 10.696 22.286 10.675 1.00 0.00 H new ATOM 0 HE3 LYS A 43 11.996 21.908 9.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 12.602 23.709 11.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 12.537 24.266 9.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 11.278 24.632 10.515 1.00 0.00 H new ATOM 650 N GLY A 44 6.698 19.832 7.910 1.00 0.00 N ATOM 651 CA GLY A 44 5.291 19.485 7.815 1.00 0.00 C ATOM 652 C GLY A 44 4.520 20.534 7.011 1.00 0.00 C ATOM 653 O GLY A 44 3.405 20.278 6.559 1.00 0.00 O ATOM 0 H GLY A 44 6.973 20.263 8.793 1.00 0.00 H new ATOM 0 HA2 GLY A 44 5.185 18.509 7.342 1.00 0.00 H new ATOM 0 HA3 GLY A 44 4.865 19.403 8.815 1.00 0.00 H new ATOM 657 N LYS A 45 5.145 21.692 6.857 1.00 0.00 N ATOM 658 CA LYS A 45 4.531 22.780 6.115 1.00 0.00 C ATOM 659 C LYS A 45 4.660 22.506 4.615 1.00 0.00 C ATOM 660 O LYS A 45 3.978 23.132 3.805 1.00 0.00 O ATOM 661 CB LYS A 45 5.123 24.123 6.547 1.00 0.00 C ATOM 662 CG LYS A 45 6.538 24.303 5.992 1.00 0.00 C ATOM 663 CD LYS A 45 6.558 25.339 4.866 1.00 0.00 C ATOM 664 CE LYS A 45 7.944 25.426 4.226 1.00 0.00 C ATOM 665 NZ LYS A 45 8.302 26.836 3.954 1.00 0.00 N ATOM 0 H LYS A 45 6.070 21.901 7.233 1.00 0.00 H new ATOM 0 HA LYS A 45 3.466 22.840 6.338 1.00 0.00 H new ATOM 0 HB2 LYS A 45 4.485 24.935 6.197 1.00 0.00 H new ATOM 0 HB3 LYS A 45 5.145 24.181 7.635 1.00 0.00 H new ATOM 0 HG2 LYS A 45 7.209 24.617 6.792 1.00 0.00 H new ATOM 0 HG3 LYS A 45 6.911 23.349 5.620 1.00 0.00 H new ATOM 0 HD2 LYS A 45 5.820 25.073 4.109 1.00 0.00 H new ATOM 0 HD3 LYS A 45 6.273 26.315 5.260 1.00 0.00 H new ATOM 0 HE2 LYS A 45 8.685 24.978 4.888 1.00 0.00 H new ATOM 0 HE3 LYS A 45 7.959 24.855 3.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 9.246 26.877 3.520 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 7.604 27.252 3.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 8.308 27.371 4.846 1.00 0.00 H new ATOM 679 N GLN A 46 5.539 21.568 4.291 1.00 0.00 N ATOM 680 CA GLN A 46 5.765 21.203 2.903 1.00 0.00 C ATOM 681 C GLN A 46 4.658 20.268 2.413 1.00 0.00 C ATOM 682 O GLN A 46 4.632 19.890 1.242 1.00 0.00 O ATOM 683 CB GLN A 46 7.143 20.564 2.722 1.00 0.00 C ATOM 684 CG GLN A 46 8.257 21.588 2.947 1.00 0.00 C ATOM 685 CD GLN A 46 9.359 21.440 1.896 1.00 0.00 C ATOM 686 OE1 GLN A 46 9.441 22.187 0.935 1.00 0.00 O ATOM 687 NE2 GLN A 46 10.199 20.436 2.132 1.00 0.00 N ATOM 0 H GLN A 46 6.102 21.050 4.966 1.00 0.00 H new ATOM 0 HA GLN A 46 5.740 22.111 2.300 1.00 0.00 H new ATOM 0 HB2 GLN A 46 7.259 19.736 3.422 1.00 0.00 H new ATOM 0 HB3 GLN A 46 7.225 20.147 1.718 1.00 0.00 H new ATOM 0 HG2 GLN A 46 7.843 22.596 2.906 1.00 0.00 H new ATOM 0 HG3 GLN A 46 8.680 21.458 3.943 1.00 0.00 H new ATOM 0 HE21 GLN A 46 10.073 19.849 2.956 1.00 0.00 H new ATOM 0 HE22 GLN A 46 10.969 20.254 1.489 1.00 0.00 H new ATOM 696 N VAL A 47 3.770 19.920 3.333 1.00 0.00 N ATOM 697 CA VAL A 47 2.663 19.036 3.009 1.00 0.00 C ATOM 698 C VAL A 47 1.388 19.558 3.674 1.00 0.00 C ATOM 699 O VAL A 47 1.443 20.150 4.751 1.00 0.00 O ATOM 700 CB VAL A 47 3.005 17.601 3.414 1.00 0.00 C ATOM 701 CG1 VAL A 47 3.618 16.831 2.243 1.00 0.00 C ATOM 702 CG2 VAL A 47 3.934 17.580 4.630 1.00 0.00 C ATOM 0 H VAL A 47 3.795 20.234 4.303 1.00 0.00 H new ATOM 0 HA VAL A 47 2.486 19.023 1.934 1.00 0.00 H new ATOM 0 HB VAL A 47 2.077 17.103 3.693 1.00 0.00 H new ATOM 0 HG11 VAL A 47 3.852 15.814 2.559 1.00 0.00 H new ATOM 0 HG12 VAL A 47 2.908 16.800 1.416 1.00 0.00 H new ATOM 0 HG13 VAL A 47 4.532 17.329 1.919 1.00 0.00 H new ATOM 0 HG21 VAL A 47 4.161 16.548 4.897 1.00 0.00 H new ATOM 0 HG22 VAL A 47 4.859 18.105 4.390 1.00 0.00 H new ATOM 0 HG23 VAL A 47 3.445 18.072 5.470 1.00 0.00 H new ATOM 712 N SER A 48 0.270 19.319 3.005 1.00 0.00 N ATOM 713 CA SER A 48 -1.017 19.757 3.517 1.00 0.00 C ATOM 714 C SER A 48 -1.858 18.546 3.926 1.00 0.00 C ATOM 715 O SER A 48 -1.847 17.521 3.246 1.00 0.00 O ATOM 716 CB SER A 48 -1.766 20.598 2.480 1.00 0.00 C ATOM 717 OG SER A 48 -0.932 21.599 1.902 1.00 0.00 O ATOM 0 H SER A 48 0.229 18.827 2.112 1.00 0.00 H new ATOM 0 HA SER A 48 -0.841 20.381 4.393 1.00 0.00 H new ATOM 0 HB2 SER A 48 -2.150 19.947 1.694 1.00 0.00 H new ATOM 0 HB3 SER A 48 -2.628 21.071 2.951 1.00 0.00 H new ATOM 0 HG SER A 48 -1.446 22.113 1.244 1.00 0.00 H new ATOM 723 N VAL A 49 -2.567 18.705 5.033 1.00 0.00 N ATOM 724 CA VAL A 49 -3.412 17.637 5.540 1.00 0.00 C ATOM 725 C VAL A 49 -4.744 18.225 6.009 1.00 0.00 C ATOM 726 O VAL A 49 -4.767 19.167 6.800 1.00 0.00 O ATOM 727 CB VAL A 49 -2.679 16.867 6.641 1.00 0.00 C ATOM 728 CG1 VAL A 49 -3.612 15.866 7.325 1.00 0.00 C ATOM 729 CG2 VAL A 49 -1.436 16.167 6.085 1.00 0.00 C ATOM 0 H VAL A 49 -2.574 19.557 5.593 1.00 0.00 H new ATOM 0 HA VAL A 49 -3.633 16.919 4.751 1.00 0.00 H new ATOM 0 HB VAL A 49 -2.352 17.586 7.392 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -3.066 15.333 8.103 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -4.452 16.398 7.771 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -3.984 15.153 6.589 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -0.933 15.627 6.887 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -1.732 15.465 5.305 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -0.757 16.910 5.666 1.00 0.00 H new ATOM 739 N ALA A 50 -5.822 17.646 5.502 1.00 0.00 N ATOM 740 CA ALA A 50 -7.155 18.101 5.859 1.00 0.00 C ATOM 741 C ALA A 50 -8.021 16.893 6.225 1.00 0.00 C ATOM 742 O ALA A 50 -8.171 15.968 5.428 1.00 0.00 O ATOM 743 CB ALA A 50 -7.744 18.912 4.703 1.00 0.00 C ATOM 0 H ALA A 50 -5.800 16.865 4.846 1.00 0.00 H new ATOM 0 HA ALA A 50 -7.117 18.755 6.730 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -8.744 19.253 4.970 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -7.108 19.774 4.502 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -7.800 18.287 3.812 1.00 0.00 H new ATOM 749 N LEU A 51 -8.568 16.941 7.430 1.00 0.00 N ATOM 750 CA LEU A 51 -9.414 15.863 7.911 1.00 0.00 C ATOM 751 C LEU A 51 -10.782 16.429 8.298 1.00 0.00 C ATOM 752 O LEU A 51 -10.866 17.461 8.961 1.00 0.00 O ATOM 753 CB LEU A 51 -8.721 15.102 9.043 1.00 0.00 C ATOM 754 CG LEU A 51 -7.358 14.495 8.706 1.00 0.00 C ATOM 755 CD1 LEU A 51 -6.550 14.221 9.977 1.00 0.00 C ATOM 756 CD2 LEU A 51 -7.514 13.240 7.845 1.00 0.00 C ATOM 0 H LEU A 51 -8.442 17.710 8.088 1.00 0.00 H new ATOM 0 HA LEU A 51 -9.583 15.130 7.122 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -8.596 15.780 9.887 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -9.382 14.301 9.373 1.00 0.00 H new ATOM 0 HG LEU A 51 -6.797 15.221 8.118 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -5.585 13.790 9.709 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -6.393 15.155 10.517 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -7.096 13.523 10.612 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -6.530 12.829 7.620 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -8.102 12.499 8.386 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -8.021 13.497 6.915 1.00 0.00 H new ATOM 768 N SER A 52 -11.820 15.727 7.868 1.00 0.00 N ATOM 769 CA SER A 52 -13.180 16.146 8.161 1.00 0.00 C ATOM 770 C SER A 52 -13.954 14.996 8.811 1.00 0.00 C ATOM 771 O SER A 52 -14.354 15.090 9.970 1.00 0.00 O ATOM 772 CB SER A 52 -13.897 16.618 6.894 1.00 0.00 C ATOM 773 OG SER A 52 -13.483 17.924 6.502 1.00 0.00 O ATOM 0 H SER A 52 -11.747 14.871 7.319 1.00 0.00 H new ATOM 0 HA SER A 52 -13.136 16.985 8.855 1.00 0.00 H new ATOM 0 HB2 SER A 52 -13.700 15.917 6.083 1.00 0.00 H new ATOM 0 HB3 SER A 52 -14.974 16.615 7.064 1.00 0.00 H new ATOM 0 HG SER A 52 -13.962 18.189 5.689 1.00 0.00 H new ATOM 779 N SER A 53 -14.140 13.938 8.036 1.00 0.00 N ATOM 780 CA SER A 53 -14.859 12.772 8.521 1.00 0.00 C ATOM 781 C SER A 53 -15.001 11.741 7.400 1.00 0.00 C ATOM 782 O SER A 53 -14.639 10.578 7.573 1.00 0.00 O ATOM 783 CB SER A 53 -16.236 13.160 9.064 1.00 0.00 C ATOM 784 OG SER A 53 -17.024 13.834 8.086 1.00 0.00 O ATOM 0 H SER A 53 -13.805 13.864 7.075 1.00 0.00 H new ATOM 0 HA SER A 53 -14.287 12.333 9.339 1.00 0.00 H new ATOM 0 HB2 SER A 53 -16.760 12.264 9.398 1.00 0.00 H new ATOM 0 HB3 SER A 53 -16.114 13.802 9.937 1.00 0.00 H new ATOM 0 HG SER A 53 -17.634 14.459 8.531 1.00 0.00 H new ATOM 790 N SER A 54 -15.527 12.204 6.276 1.00 0.00 N ATOM 791 CA SER A 54 -15.721 11.336 5.127 1.00 0.00 C ATOM 792 C SER A 54 -14.912 11.855 3.937 1.00 0.00 C ATOM 793 O SER A 54 -15.338 11.728 2.790 1.00 0.00 O ATOM 794 CB SER A 54 -17.203 11.234 4.758 1.00 0.00 C ATOM 795 OG SER A 54 -17.589 9.893 4.468 1.00 0.00 O ATOM 0 H SER A 54 -15.825 13.169 6.136 1.00 0.00 H new ATOM 0 HA SER A 54 -15.370 10.338 5.389 1.00 0.00 H new ATOM 0 HB2 SER A 54 -17.809 11.616 5.580 1.00 0.00 H new ATOM 0 HB3 SER A 54 -17.406 11.865 3.893 1.00 0.00 H new ATOM 0 HG SER A 54 -16.819 9.298 4.586 1.00 0.00 H new ATOM 801 N SER A 55 -13.760 12.429 4.250 1.00 0.00 N ATOM 802 CA SER A 55 -12.888 12.968 3.221 1.00 0.00 C ATOM 803 C SER A 55 -11.484 13.191 3.788 1.00 0.00 C ATOM 804 O SER A 55 -11.261 13.021 4.985 1.00 0.00 O ATOM 805 CB SER A 55 -13.445 14.276 2.656 1.00 0.00 C ATOM 806 OG SER A 55 -12.569 14.859 1.695 1.00 0.00 O ATOM 0 H SER A 55 -13.410 12.533 5.202 1.00 0.00 H new ATOM 0 HA SER A 55 -12.834 12.245 2.407 1.00 0.00 H new ATOM 0 HB2 SER A 55 -14.415 14.088 2.195 1.00 0.00 H new ATOM 0 HB3 SER A 55 -13.610 14.981 3.470 1.00 0.00 H new ATOM 0 HG SER A 55 -12.961 15.691 1.357 1.00 0.00 H new ATOM 812 N ILE A 56 -10.575 13.567 2.901 1.00 0.00 N ATOM 813 CA ILE A 56 -9.200 13.815 3.298 1.00 0.00 C ATOM 814 C ILE A 56 -8.481 14.577 2.182 1.00 0.00 C ATOM 815 O ILE A 56 -8.893 14.524 1.025 1.00 0.00 O ATOM 816 CB ILE A 56 -8.512 12.506 3.691 1.00 0.00 C ATOM 817 CG1 ILE A 56 -7.200 12.777 4.431 1.00 0.00 C ATOM 818 CG2 ILE A 56 -8.306 11.606 2.470 1.00 0.00 C ATOM 819 CD1 ILE A 56 -6.073 13.101 3.448 1.00 0.00 C ATOM 0 H ILE A 56 -10.764 13.706 1.908 1.00 0.00 H new ATOM 0 HA ILE A 56 -9.167 14.445 4.187 1.00 0.00 H new ATOM 0 HB ILE A 56 -9.166 11.970 4.379 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -7.334 13.608 5.123 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -6.928 11.906 5.027 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -7.815 10.683 2.777 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -9.272 11.372 2.023 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -7.684 12.122 1.739 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -5.152 13.289 4.000 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -5.926 12.258 2.773 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -6.338 13.987 2.870 1.00 0.00 H new ATOM 831 N ARG A 57 -7.419 15.267 2.571 1.00 0.00 N ATOM 832 CA ARG A 57 -6.639 16.039 1.618 1.00 0.00 C ATOM 833 C ARG A 57 -5.144 15.872 1.898 1.00 0.00 C ATOM 834 O ARG A 57 -4.693 16.075 3.024 1.00 0.00 O ATOM 835 CB ARG A 57 -7.001 17.524 1.684 1.00 0.00 C ATOM 836 CG ARG A 57 -6.740 18.212 0.343 1.00 0.00 C ATOM 837 CD ARG A 57 -5.883 19.466 0.528 1.00 0.00 C ATOM 838 NE ARG A 57 -5.717 20.161 -0.768 1.00 0.00 N ATOM 839 CZ ARG A 57 -4.763 21.068 -1.018 1.00 0.00 C ATOM 840 NH1 ARG A 57 -3.882 21.394 -0.062 1.00 0.00 N ATOM 841 NH2 ARG A 57 -4.688 21.648 -2.224 1.00 0.00 N ATOM 0 H ARG A 57 -7.080 15.308 3.532 1.00 0.00 H new ATOM 0 HA ARG A 57 -6.870 15.665 0.620 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -8.051 17.634 1.955 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -6.417 18.010 2.466 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -6.237 17.520 -0.333 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -7.688 18.481 -0.123 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -6.352 20.134 1.251 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -4.908 19.194 0.932 1.00 0.00 H new ATOM 0 HE ARG A 57 -6.370 19.935 -1.518 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -3.938 20.952 0.855 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -3.156 22.084 -0.252 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -5.357 21.399 -2.952 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -3.961 22.338 -2.414 1.00 0.00 H new ATOM 855 N VAL A 58 -4.416 15.505 0.853 1.00 0.00 N ATOM 856 CA VAL A 58 -2.981 15.310 0.973 1.00 0.00 C ATOM 857 C VAL A 58 -2.279 15.983 -0.208 1.00 0.00 C ATOM 858 O VAL A 58 -2.696 15.826 -1.355 1.00 0.00 O ATOM 859 CB VAL A 58 -2.664 13.817 1.085 1.00 0.00 C ATOM 860 CG1 VAL A 58 -1.165 13.589 1.290 1.00 0.00 C ATOM 861 CG2 VAL A 58 -3.477 13.167 2.206 1.00 0.00 C ATOM 0 H VAL A 58 -4.793 15.338 -0.080 1.00 0.00 H new ATOM 0 HA VAL A 58 -2.606 15.778 1.883 1.00 0.00 H new ATOM 0 HB VAL A 58 -2.949 13.342 0.146 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -0.967 12.520 1.367 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -0.615 14.000 0.443 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -0.844 14.084 2.206 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -3.233 12.106 2.264 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -3.237 13.647 3.155 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -4.541 13.284 1.999 1.00 0.00 H new ATOM 871 N ALA A 59 -1.225 16.718 0.112 1.00 0.00 N ATOM 872 CA ALA A 59 -0.461 17.416 -0.908 1.00 0.00 C ATOM 873 C ALA A 59 0.938 17.725 -0.369 1.00 0.00 C ATOM 874 O ALA A 59 1.147 17.758 0.842 1.00 0.00 O ATOM 875 CB ALA A 59 -1.213 18.678 -1.335 1.00 0.00 C ATOM 0 H ALA A 59 -0.882 16.846 1.064 1.00 0.00 H new ATOM 0 HA ALA A 59 -0.343 16.792 -1.794 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -0.640 19.202 -2.100 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -2.188 18.402 -1.737 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -1.348 19.331 -0.472 1.00 0.00 H new ATOM 881 N MET A 60 1.859 17.944 -1.296 1.00 0.00 N ATOM 882 CA MET A 60 3.231 18.249 -0.930 1.00 0.00 C ATOM 883 C MET A 60 3.812 19.336 -1.837 1.00 0.00 C ATOM 884 O MET A 60 3.536 19.363 -3.035 1.00 0.00 O ATOM 885 CB MET A 60 4.083 16.983 -1.041 1.00 0.00 C ATOM 886 CG MET A 60 4.065 16.434 -2.469 1.00 0.00 C ATOM 887 SD MET A 60 5.721 16.003 -2.978 1.00 0.00 S ATOM 888 CE MET A 60 6.498 17.608 -2.895 1.00 0.00 C ATOM 0 H MET A 60 1.682 17.916 -2.300 1.00 0.00 H new ATOM 0 HA MET A 60 3.240 18.615 0.097 1.00 0.00 H new ATOM 0 HB2 MET A 60 5.109 17.203 -0.745 1.00 0.00 H new ATOM 0 HB3 MET A 60 3.708 16.226 -0.352 1.00 0.00 H new ATOM 0 HG2 MET A 60 3.420 15.557 -2.522 1.00 0.00 H new ATOM 0 HG3 MET A 60 3.649 17.178 -3.148 1.00 0.00 H new ATOM 0 HE1 MET A 60 7.364 17.627 -3.556 1.00 0.00 H new ATOM 0 HE2 MET A 60 5.787 18.373 -3.206 1.00 0.00 H new ATOM 0 HE3 MET A 60 6.818 17.805 -1.872 1.00 0.00 H new ATOM 898 N LEU A 61 4.606 20.206 -1.230 1.00 0.00 N ATOM 899 CA LEU A 61 5.228 21.293 -1.967 1.00 0.00 C ATOM 900 C LEU A 61 6.374 20.738 -2.815 1.00 0.00 C ATOM 901 O LEU A 61 7.240 20.028 -2.307 1.00 0.00 O ATOM 902 CB LEU A 61 5.654 22.412 -1.015 1.00 0.00 C ATOM 903 CG LEU A 61 4.522 23.150 -0.297 1.00 0.00 C ATOM 904 CD1 LEU A 61 5.002 24.499 0.242 1.00 0.00 C ATOM 905 CD2 LEU A 61 3.301 23.297 -1.207 1.00 0.00 C ATOM 0 H LEU A 61 4.833 20.180 -0.236 1.00 0.00 H new ATOM 0 HA LEU A 61 4.512 21.746 -2.653 1.00 0.00 H new ATOM 0 HB2 LEU A 61 6.319 21.988 -0.263 1.00 0.00 H new ATOM 0 HB3 LEU A 61 6.235 23.141 -1.580 1.00 0.00 H new ATOM 0 HG LEU A 61 4.214 22.553 0.561 1.00 0.00 H new ATOM 0 HD11 LEU A 61 4.178 25.003 0.748 1.00 0.00 H new ATOM 0 HD12 LEU A 61 5.818 24.340 0.947 1.00 0.00 H new ATOM 0 HD13 LEU A 61 5.353 25.117 -0.584 1.00 0.00 H new ATOM 0 HD21 LEU A 61 2.511 23.825 -0.673 1.00 0.00 H new ATOM 0 HD22 LEU A 61 3.577 23.862 -2.098 1.00 0.00 H new ATOM 0 HD23 LEU A 61 2.944 22.309 -1.500 1.00 0.00 H new ATOM 917 N GLU A 62 6.342 21.082 -4.094 1.00 0.00 N ATOM 918 CA GLU A 62 7.367 20.627 -5.018 1.00 0.00 C ATOM 919 C GLU A 62 8.488 21.663 -5.119 1.00 0.00 C ATOM 920 O GLU A 62 9.565 21.474 -4.557 1.00 0.00 O ATOM 921 CB GLU A 62 6.770 20.328 -6.395 1.00 0.00 C ATOM 922 CG GLU A 62 6.105 18.951 -6.417 1.00 0.00 C ATOM 923 CD GLU A 62 7.099 17.869 -6.844 1.00 0.00 C ATOM 924 OE1 GLU A 62 7.857 18.140 -7.800 1.00 0.00 O ATOM 925 OE2 GLU A 62 7.078 16.795 -6.205 1.00 0.00 O ATOM 0 H GLU A 62 5.622 21.671 -4.512 1.00 0.00 H new ATOM 0 HA GLU A 62 7.790 19.699 -4.633 1.00 0.00 H new ATOM 0 HB2 GLU A 62 6.038 21.094 -6.652 1.00 0.00 H new ATOM 0 HB3 GLU A 62 7.553 20.370 -7.152 1.00 0.00 H new ATOM 0 HG2 GLU A 62 5.711 18.718 -5.428 1.00 0.00 H new ATOM 0 HG3 GLU A 62 5.258 18.963 -7.103 1.00 0.00 H new ATOM 932 N GLU A 63 8.196 22.736 -5.841 1.00 0.00 N ATOM 933 CA GLU A 63 9.166 23.802 -6.023 1.00 0.00 C ATOM 934 C GLU A 63 8.457 25.107 -6.392 1.00 0.00 C ATOM 935 O GLU A 63 8.444 26.053 -5.606 1.00 0.00 O ATOM 936 CB GLU A 63 10.204 23.424 -7.081 1.00 0.00 C ATOM 937 CG GLU A 63 11.521 22.995 -6.430 1.00 0.00 C ATOM 938 CD GLU A 63 11.962 21.621 -6.937 1.00 0.00 C ATOM 939 OE1 GLU A 63 12.202 21.518 -8.160 1.00 0.00 O ATOM 940 OE2 GLU A 63 12.050 20.705 -6.092 1.00 0.00 O ATOM 0 H GLU A 63 7.301 22.889 -6.306 1.00 0.00 H new ATOM 0 HA GLU A 63 9.694 23.951 -5.081 1.00 0.00 H new ATOM 0 HB2 GLU A 63 9.819 22.613 -7.700 1.00 0.00 H new ATOM 0 HB3 GLU A 63 10.381 24.273 -7.742 1.00 0.00 H new ATOM 0 HG2 GLU A 63 12.295 23.732 -6.647 1.00 0.00 H new ATOM 0 HG3 GLU A 63 11.403 22.966 -5.347 1.00 0.00 H new ATOM 947 N ASN A 64 7.886 25.115 -7.587 1.00 0.00 N ATOM 948 CA ASN A 64 7.177 26.288 -8.069 1.00 0.00 C ATOM 949 C ASN A 64 5.712 26.207 -7.637 1.00 0.00 C ATOM 950 O ASN A 64 4.953 27.157 -7.822 1.00 0.00 O ATOM 951 CB ASN A 64 7.216 26.366 -9.597 1.00 0.00 C ATOM 952 CG ASN A 64 8.214 27.427 -10.067 1.00 0.00 C ATOM 953 OD1 ASN A 64 9.234 27.674 -9.446 1.00 0.00 O ATOM 954 ND2 ASN A 64 7.863 28.037 -11.195 1.00 0.00 N ATOM 0 H ASN A 64 7.900 24.328 -8.236 1.00 0.00 H new ATOM 0 HA ASN A 64 7.661 27.170 -7.650 1.00 0.00 H new ATOM 0 HB2 ASN A 64 7.492 25.395 -10.007 1.00 0.00 H new ATOM 0 HB3 ASN A 64 6.222 26.602 -9.978 1.00 0.00 H new ATOM 0 HD21 ASN A 64 8.463 28.761 -11.591 1.00 0.00 H new ATOM 0 HD22 ASN A 64 6.994 27.781 -11.664 1.00 0.00 H new ATOM 961 N GLY A 65 5.358 25.063 -7.071 1.00 0.00 N ATOM 962 CA GLY A 65 3.997 24.845 -6.611 1.00 0.00 C ATOM 963 C GLY A 65 3.923 23.644 -5.666 1.00 0.00 C ATOM 964 O GLY A 65 4.752 23.504 -4.769 1.00 0.00 O ATOM 0 H GLY A 65 5.990 24.277 -6.920 1.00 0.00 H new ATOM 0 HA2 GLY A 65 3.635 25.737 -6.100 1.00 0.00 H new ATOM 0 HA3 GLY A 65 3.342 24.680 -7.467 1.00 0.00 H new ATOM 968 N GLU A 66 2.921 22.809 -5.899 1.00 0.00 N ATOM 969 CA GLU A 66 2.728 21.625 -5.080 1.00 0.00 C ATOM 970 C GLU A 66 1.968 20.554 -5.865 1.00 0.00 C ATOM 971 O GLU A 66 1.615 20.763 -7.024 1.00 0.00 O ATOM 972 CB GLU A 66 2.000 21.971 -3.779 1.00 0.00 C ATOM 973 CG GLU A 66 0.490 22.068 -4.005 1.00 0.00 C ATOM 974 CD GLU A 66 0.157 23.169 -5.015 1.00 0.00 C ATOM 975 OE1 GLU A 66 0.436 24.342 -4.688 1.00 0.00 O ATOM 976 OE2 GLU A 66 -0.370 22.811 -6.091 1.00 0.00 O ATOM 0 H GLU A 66 2.234 22.929 -6.643 1.00 0.00 H new ATOM 0 HA GLU A 66 3.708 21.227 -4.815 1.00 0.00 H new ATOM 0 HB2 GLU A 66 2.211 21.211 -3.027 1.00 0.00 H new ATOM 0 HB3 GLU A 66 2.375 22.917 -3.389 1.00 0.00 H new ATOM 0 HG2 GLU A 66 0.110 21.112 -4.365 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -0.011 22.274 -3.059 1.00 0.00 H new ATOM 983 N ARG A 67 1.739 19.430 -5.202 1.00 0.00 N ATOM 984 CA ARG A 67 1.028 18.326 -5.823 1.00 0.00 C ATOM 985 C ARG A 67 0.187 17.584 -4.783 1.00 0.00 C ATOM 986 O ARG A 67 0.608 17.423 -3.638 1.00 0.00 O ATOM 987 CB ARG A 67 2.000 17.343 -6.478 1.00 0.00 C ATOM 988 CG ARG A 67 1.258 16.128 -7.037 1.00 0.00 C ATOM 989 CD ARG A 67 2.007 15.528 -8.229 1.00 0.00 C ATOM 990 NE ARG A 67 1.060 15.233 -9.326 1.00 0.00 N ATOM 991 CZ ARG A 67 1.349 14.458 -10.381 1.00 0.00 C ATOM 992 NH1 ARG A 67 2.561 13.896 -10.487 1.00 0.00 N ATOM 993 NH2 ARG A 67 0.426 14.245 -11.329 1.00 0.00 N ATOM 0 H ARG A 67 2.034 19.260 -4.240 1.00 0.00 H new ATOM 0 HA ARG A 67 0.377 18.742 -6.592 1.00 0.00 H new ATOM 0 HB2 ARG A 67 2.543 17.843 -7.280 1.00 0.00 H new ATOM 0 HB3 ARG A 67 2.740 17.017 -5.747 1.00 0.00 H new ATOM 0 HG2 ARG A 67 1.146 15.375 -6.257 1.00 0.00 H new ATOM 0 HG3 ARG A 67 0.254 16.420 -7.344 1.00 0.00 H new ATOM 0 HD2 ARG A 67 2.772 16.223 -8.575 1.00 0.00 H new ATOM 0 HD3 ARG A 67 2.519 14.615 -7.925 1.00 0.00 H new ATOM 0 HE ARG A 67 0.128 15.645 -9.277 1.00 0.00 H new ATOM 0 HH11 ARG A 67 3.263 14.058 -9.765 1.00 0.00 H new ATOM 0 HH12 ARG A 67 2.781 13.306 -11.290 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -0.496 14.673 -11.248 1.00 0.00 H new ATOM 0 HH22 ARG A 67 0.646 13.655 -12.132 1.00 0.00 H new ATOM 1007 N VAL A 68 -0.988 17.151 -5.217 1.00 0.00 N ATOM 1008 CA VAL A 68 -1.892 16.430 -4.338 1.00 0.00 C ATOM 1009 C VAL A 68 -1.641 14.927 -4.476 1.00 0.00 C ATOM 1010 O VAL A 68 -2.147 14.292 -5.400 1.00 0.00 O ATOM 1011 CB VAL A 68 -3.340 16.824 -4.638 1.00 0.00 C ATOM 1012 CG1 VAL A 68 -4.314 16.056 -3.743 1.00 0.00 C ATOM 1013 CG2 VAL A 68 -3.538 18.334 -4.495 1.00 0.00 C ATOM 0 H VAL A 68 -1.335 17.286 -6.167 1.00 0.00 H new ATOM 0 HA VAL A 68 -1.706 16.697 -3.298 1.00 0.00 H new ATOM 0 HB VAL A 68 -3.553 16.555 -5.673 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -5.336 16.355 -3.977 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -4.200 14.986 -3.916 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -4.101 16.279 -2.698 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -4.575 18.587 -4.714 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -3.297 18.638 -3.476 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -2.883 18.855 -5.193 1.00 0.00 H new ATOM 1023 N LEU A 69 -0.859 14.403 -3.544 1.00 0.00 N ATOM 1024 CA LEU A 69 -0.534 12.986 -3.550 1.00 0.00 C ATOM 1025 C LEU A 69 -1.823 12.171 -3.427 1.00 0.00 C ATOM 1026 O LEU A 69 -2.078 11.281 -4.237 1.00 0.00 O ATOM 1027 CB LEU A 69 0.499 12.669 -2.467 1.00 0.00 C ATOM 1028 CG LEU A 69 1.790 13.489 -2.511 1.00 0.00 C ATOM 1029 CD1 LEU A 69 2.649 13.227 -1.272 1.00 0.00 C ATOM 1030 CD2 LEU A 69 2.561 13.230 -3.807 1.00 0.00 C ATOM 0 H LEU A 69 -0.441 14.933 -2.780 1.00 0.00 H new ATOM 0 HA LEU A 69 -0.068 12.706 -4.495 1.00 0.00 H new ATOM 0 HB2 LEU A 69 0.032 12.816 -1.493 1.00 0.00 H new ATOM 0 HB3 LEU A 69 0.760 11.613 -2.540 1.00 0.00 H new ATOM 0 HG LEU A 69 1.523 14.546 -2.501 1.00 0.00 H new ATOM 0 HD11 LEU A 69 3.560 13.822 -1.329 1.00 0.00 H new ATOM 0 HD12 LEU A 69 2.091 13.503 -0.377 1.00 0.00 H new ATOM 0 HD13 LEU A 69 2.909 12.169 -1.226 1.00 0.00 H new ATOM 0 HD21 LEU A 69 3.474 13.825 -3.812 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.817 12.173 -3.873 1.00 0.00 H new ATOM 0 HD23 LEU A 69 1.942 13.508 -4.660 1.00 0.00 H new ATOM 1042 N MET A 70 -2.602 12.504 -2.408 1.00 0.00 N ATOM 1043 CA MET A 70 -3.858 11.814 -2.169 1.00 0.00 C ATOM 1044 C MET A 70 -4.960 12.801 -1.780 1.00 0.00 C ATOM 1045 O MET A 70 -4.698 13.797 -1.108 1.00 0.00 O ATOM 1046 CB MET A 70 -3.672 10.788 -1.050 1.00 0.00 C ATOM 1047 CG MET A 70 -5.002 10.123 -0.690 1.00 0.00 C ATOM 1048 SD MET A 70 -4.804 9.111 0.767 1.00 0.00 S ATOM 1049 CE MET A 70 -6.456 8.451 0.913 1.00 0.00 C ATOM 0 H MET A 70 -2.387 13.243 -1.738 1.00 0.00 H new ATOM 0 HA MET A 70 -4.156 11.311 -3.089 1.00 0.00 H new ATOM 0 HB2 MET A 70 -2.955 10.029 -1.363 1.00 0.00 H new ATOM 0 HB3 MET A 70 -3.255 11.277 -0.169 1.00 0.00 H new ATOM 0 HG2 MET A 70 -5.762 10.884 -0.514 1.00 0.00 H new ATOM 0 HG3 MET A 70 -5.350 9.512 -1.523 1.00 0.00 H new ATOM 0 HE1 MET A 70 -6.888 8.760 1.865 1.00 0.00 H new ATOM 0 HE2 MET A 70 -7.072 8.827 0.096 1.00 0.00 H new ATOM 0 HE3 MET A 70 -6.418 7.363 0.868 1.00 0.00 H new ATOM 1059 N GLU A 71 -6.171 12.490 -2.220 1.00 0.00 N ATOM 1060 CA GLU A 71 -7.314 13.338 -1.926 1.00 0.00 C ATOM 1061 C GLU A 71 -8.591 12.726 -2.506 1.00 0.00 C ATOM 1062 O GLU A 71 -8.537 11.970 -3.475 1.00 0.00 O ATOM 1063 CB GLU A 71 -7.096 14.756 -2.455 1.00 0.00 C ATOM 1064 CG GLU A 71 -8.178 15.707 -1.940 1.00 0.00 C ATOM 1065 CD GLU A 71 -9.446 15.607 -2.791 1.00 0.00 C ATOM 1066 OE1 GLU A 71 -9.299 15.625 -4.032 1.00 0.00 O ATOM 1067 OE2 GLU A 71 -10.533 15.515 -2.181 1.00 0.00 O ATOM 0 H GLU A 71 -6.385 11.663 -2.777 1.00 0.00 H new ATOM 0 HA GLU A 71 -7.424 13.403 -0.844 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -6.114 15.116 -2.147 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -7.104 14.746 -3.545 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -8.412 15.469 -0.902 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -7.805 16.731 -1.956 1.00 0.00 H new ATOM 1074 N GLY A 72 -9.710 13.078 -1.890 1.00 0.00 N ATOM 1075 CA GLY A 72 -10.998 12.573 -2.334 1.00 0.00 C ATOM 1076 C GLY A 72 -11.888 12.218 -1.141 1.00 0.00 C ATOM 1077 O GLY A 72 -11.397 12.032 -0.029 1.00 0.00 O ATOM 0 H GLY A 72 -9.751 13.706 -1.088 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -11.493 13.322 -2.952 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -10.852 11.692 -2.958 1.00 0.00 H new ATOM 1081 N LYS A 73 -13.182 12.134 -1.413 1.00 0.00 N ATOM 1082 CA LYS A 73 -14.145 11.804 -0.376 1.00 0.00 C ATOM 1083 C LYS A 73 -13.994 10.330 0.004 1.00 0.00 C ATOM 1084 O LYS A 73 -13.861 9.472 -0.867 1.00 0.00 O ATOM 1085 CB LYS A 73 -15.560 12.184 -0.818 1.00 0.00 C ATOM 1086 CG LYS A 73 -15.811 13.681 -0.625 1.00 0.00 C ATOM 1087 CD LYS A 73 -17.166 14.089 -1.208 1.00 0.00 C ATOM 1088 CE LYS A 73 -17.203 15.588 -1.512 1.00 0.00 C ATOM 1089 NZ LYS A 73 -18.345 15.909 -2.396 1.00 0.00 N ATOM 0 H LYS A 73 -13.586 12.289 -2.337 1.00 0.00 H new ATOM 0 HA LYS A 73 -13.950 12.387 0.524 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -15.701 11.920 -1.866 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -16.290 11.612 -0.245 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -15.780 13.925 0.437 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -15.017 14.252 -1.107 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -17.358 13.524 -2.120 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -17.959 13.837 -0.504 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -17.285 16.152 -0.583 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -16.271 15.892 -1.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -18.356 16.930 -2.593 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -18.250 15.385 -3.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -19.233 15.637 -1.928 1.00 0.00 H new ATOM 1103 N LEU A 74 -14.021 10.081 1.305 1.00 0.00 N ATOM 1104 CA LEU A 74 -13.889 8.726 1.811 1.00 0.00 C ATOM 1105 C LEU A 74 -15.191 7.963 1.560 1.00 0.00 C ATOM 1106 O LEU A 74 -16.161 8.532 1.062 1.00 0.00 O ATOM 1107 CB LEU A 74 -13.458 8.741 3.279 1.00 0.00 C ATOM 1108 CG LEU A 74 -12.148 9.470 3.586 1.00 0.00 C ATOM 1109 CD1 LEU A 74 -12.077 9.872 5.061 1.00 0.00 C ATOM 1110 CD2 LEU A 74 -10.941 8.632 3.161 1.00 0.00 C ATOM 0 H LEU A 74 -14.132 10.796 2.024 1.00 0.00 H new ATOM 0 HA LEU A 74 -13.100 8.196 1.277 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -14.253 9.201 3.866 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -13.366 7.710 3.621 1.00 0.00 H new ATOM 0 HG LEU A 74 -12.123 10.389 3.000 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -11.136 10.388 5.253 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -12.909 10.535 5.298 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -12.135 8.980 5.684 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -10.023 9.173 3.390 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -10.948 7.685 3.700 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -10.991 8.440 2.089 1.00 0.00 H new ATOM 1122 N THR A 75 -15.171 6.687 1.917 1.00 0.00 N ATOM 1123 CA THR A 75 -16.338 5.841 1.737 1.00 0.00 C ATOM 1124 C THR A 75 -17.280 5.970 2.936 1.00 0.00 C ATOM 1125 O THR A 75 -18.495 5.839 2.792 1.00 0.00 O ATOM 1126 CB THR A 75 -15.853 4.410 1.497 1.00 0.00 C ATOM 1127 OG1 THR A 75 -14.989 4.147 2.600 1.00 0.00 O ATOM 1128 CG2 THR A 75 -14.939 4.299 0.274 1.00 0.00 C ATOM 0 H THR A 75 -14.365 6.219 2.330 1.00 0.00 H new ATOM 0 HA THR A 75 -16.921 6.151 0.870 1.00 0.00 H new ATOM 0 HB THR A 75 -16.713 3.752 1.369 1.00 0.00 H new ATOM 0 HG1 THR A 75 -14.192 3.672 2.285 1.00 0.00 H new ATOM 0 HG21 THR A 75 -14.623 3.263 0.149 1.00 0.00 H new ATOM 0 HG22 THR A 75 -15.480 4.624 -0.615 1.00 0.00 H new ATOM 0 HG23 THR A 75 -14.062 4.931 0.416 1.00 0.00 H new ATOM 1136 N HIS A 76 -16.684 6.226 4.091 1.00 0.00 N ATOM 1137 CA HIS A 76 -17.455 6.374 5.314 1.00 0.00 C ATOM 1138 C HIS A 76 -16.883 7.524 6.145 1.00 0.00 C ATOM 1139 O HIS A 76 -16.029 8.272 5.671 1.00 0.00 O ATOM 1140 CB HIS A 76 -17.508 5.054 6.086 1.00 0.00 C ATOM 1141 CG HIS A 76 -18.764 4.251 5.843 1.00 0.00 C ATOM 1142 ND1 HIS A 76 -18.740 2.930 5.428 1.00 0.00 N ATOM 1143 CD2 HIS A 76 -20.078 4.594 5.961 1.00 0.00 C ATOM 1144 CE1 HIS A 76 -19.990 2.508 5.305 1.00 0.00 C ATOM 1145 NE2 HIS A 76 -20.818 3.541 5.635 1.00 0.00 N ATOM 0 H HIS A 76 -15.676 6.335 4.206 1.00 0.00 H new ATOM 0 HA HIS A 76 -18.487 6.626 5.069 1.00 0.00 H new ATOM 0 HB2 HIS A 76 -16.644 4.449 5.812 1.00 0.00 H new ATOM 0 HB3 HIS A 76 -17.424 5.265 7.152 1.00 0.00 H new ATOM 0 HD1 HIS A 76 -17.903 2.376 5.248 1.00 0.00 H new ATOM 0 HD2 HIS A 76 -20.454 5.559 6.268 1.00 0.00 H new ATOM 0 HE1 HIS A 76 -20.299 1.520 4.998 1.00 0.00 H new ATOM 1153 N LYS A 77 -17.376 7.629 7.370 1.00 0.00 N ATOM 1154 CA LYS A 77 -16.925 8.675 8.272 1.00 0.00 C ATOM 1155 C LYS A 77 -15.787 8.137 9.142 1.00 0.00 C ATOM 1156 O LYS A 77 -15.482 6.946 9.104 1.00 0.00 O ATOM 1157 CB LYS A 77 -18.101 9.235 9.075 1.00 0.00 C ATOM 1158 CG LYS A 77 -19.009 10.093 8.191 1.00 0.00 C ATOM 1159 CD LYS A 77 -19.853 11.048 9.037 1.00 0.00 C ATOM 1160 CE LYS A 77 -20.542 12.095 8.159 1.00 0.00 C ATOM 1161 NZ LYS A 77 -20.548 13.413 8.831 1.00 0.00 N ATOM 0 H LYS A 77 -18.084 7.006 7.759 1.00 0.00 H new ATOM 0 HA LYS A 77 -16.525 9.517 7.708 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -18.676 8.415 9.505 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -17.727 9.832 9.906 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -18.403 10.664 7.487 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -19.662 9.450 7.601 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -20.602 10.483 9.591 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -19.220 11.544 9.772 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -20.027 12.171 7.201 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -21.565 11.784 7.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -21.019 14.111 8.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -21.060 13.340 9.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -19.569 13.715 9.011 1.00 0.00 H new ATOM 1175 N ILE A 78 -15.191 9.040 9.906 1.00 0.00 N ATOM 1176 CA ILE A 78 -14.094 8.671 10.784 1.00 0.00 C ATOM 1177 C ILE A 78 -14.070 9.615 11.988 1.00 0.00 C ATOM 1178 O ILE A 78 -14.901 10.516 12.091 1.00 0.00 O ATOM 1179 CB ILE A 78 -12.776 8.632 10.008 1.00 0.00 C ATOM 1180 CG1 ILE A 78 -12.448 10.004 9.414 1.00 0.00 C ATOM 1181 CG2 ILE A 78 -12.801 7.537 8.939 1.00 0.00 C ATOM 1182 CD1 ILE A 78 -11.417 10.739 10.272 1.00 0.00 C ATOM 0 H ILE A 78 -15.447 10.027 9.935 1.00 0.00 H new ATOM 0 HA ILE A 78 -14.240 7.663 11.171 1.00 0.00 H new ATOM 0 HB ILE A 78 -11.977 8.383 10.706 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -12.064 9.884 8.401 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -13.358 10.600 9.341 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -11.852 7.531 8.402 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -12.955 6.568 9.414 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -13.613 7.731 8.238 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -11.201 11.711 9.828 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -11.814 10.879 11.277 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -10.500 10.151 10.322 1.00 0.00 H new ATOM 1194 N ASN A 79 -13.109 9.375 12.868 1.00 0.00 N ATOM 1195 CA ASN A 79 -12.967 10.192 14.061 1.00 0.00 C ATOM 1196 C ASN A 79 -11.722 11.072 13.926 1.00 0.00 C ATOM 1197 O ASN A 79 -10.665 10.745 14.463 1.00 0.00 O ATOM 1198 CB ASN A 79 -12.797 9.322 15.308 1.00 0.00 C ATOM 1199 CG ASN A 79 -13.393 10.007 16.540 1.00 0.00 C ATOM 1200 OD1 ASN A 79 -13.355 11.217 16.689 1.00 0.00 O ATOM 1201 ND2 ASN A 79 -13.944 9.167 17.411 1.00 0.00 N ATOM 0 H ASN A 79 -12.422 8.627 12.779 1.00 0.00 H new ATOM 0 HA ASN A 79 -13.867 10.798 14.164 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -13.283 8.359 15.153 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -11.739 9.122 15.475 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -14.369 9.525 18.266 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -13.941 8.164 17.224 1.00 0.00 H new ATOM 1208 N THR A 80 -11.889 12.171 13.205 1.00 0.00 N ATOM 1209 CA THR A 80 -10.792 13.100 12.992 1.00 0.00 C ATOM 1210 C THR A 80 -10.065 13.377 14.309 1.00 0.00 C ATOM 1211 O THR A 80 -8.836 13.406 14.350 1.00 0.00 O ATOM 1212 CB THR A 80 -11.360 14.360 12.335 1.00 0.00 C ATOM 1213 OG1 THR A 80 -12.280 14.869 13.297 1.00 0.00 O ATOM 1214 CG2 THR A 80 -12.232 14.043 11.118 1.00 0.00 C ATOM 0 H THR A 80 -12.767 12.439 12.761 1.00 0.00 H new ATOM 0 HA THR A 80 -10.041 12.678 12.324 1.00 0.00 H new ATOM 0 HB THR A 80 -10.541 15.013 12.035 1.00 0.00 H new ATOM 0 HG1 THR A 80 -12.693 15.688 12.953 1.00 0.00 H new ATOM 0 HG21 THR A 80 -12.610 14.971 10.689 1.00 0.00 H new ATOM 0 HG22 THR A 80 -11.638 13.514 10.372 1.00 0.00 H new ATOM 0 HG23 THR A 80 -13.070 13.417 11.424 1.00 0.00 H new ATOM 1222 N GLU A 81 -10.855 13.574 15.354 1.00 0.00 N ATOM 1223 CA GLU A 81 -10.302 13.848 16.670 1.00 0.00 C ATOM 1224 C GLU A 81 -9.334 12.737 17.080 1.00 0.00 C ATOM 1225 O GLU A 81 -8.198 13.009 17.466 1.00 0.00 O ATOM 1226 CB GLU A 81 -11.413 14.019 17.707 1.00 0.00 C ATOM 1227 CG GLU A 81 -12.210 15.300 17.452 1.00 0.00 C ATOM 1228 CD GLU A 81 -13.102 15.638 18.648 1.00 0.00 C ATOM 1229 OE1 GLU A 81 -12.528 15.967 19.709 1.00 0.00 O ATOM 1230 OE2 GLU A 81 -14.337 15.561 18.475 1.00 0.00 O ATOM 0 H GLU A 81 -11.874 13.549 15.316 1.00 0.00 H new ATOM 0 HA GLU A 81 -9.748 14.786 16.622 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -12.081 13.158 17.674 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -10.980 14.049 18.707 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -11.526 16.126 17.259 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -12.823 15.179 16.559 1.00 0.00 H new ATOM 1237 N SER A 82 -9.819 11.508 16.983 1.00 0.00 N ATOM 1238 CA SER A 82 -9.011 10.354 17.340 1.00 0.00 C ATOM 1239 C SER A 82 -7.963 10.094 16.257 1.00 0.00 C ATOM 1240 O SER A 82 -6.940 9.462 16.517 1.00 0.00 O ATOM 1241 CB SER A 82 -9.883 9.113 17.543 1.00 0.00 C ATOM 1242 OG SER A 82 -9.611 8.466 18.784 1.00 0.00 O ATOM 0 H SER A 82 -10.761 11.286 16.662 1.00 0.00 H new ATOM 0 HA SER A 82 -8.506 10.568 18.282 1.00 0.00 H new ATOM 0 HB2 SER A 82 -10.934 9.399 17.506 1.00 0.00 H new ATOM 0 HB3 SER A 82 -9.714 8.413 16.725 1.00 0.00 H new ATOM 0 HG SER A 82 -10.189 7.680 18.877 1.00 0.00 H new ATOM 1248 N SER A 83 -8.253 10.595 15.065 1.00 0.00 N ATOM 1249 CA SER A 83 -7.347 10.426 13.941 1.00 0.00 C ATOM 1250 C SER A 83 -6.126 11.331 14.112 1.00 0.00 C ATOM 1251 O SER A 83 -6.158 12.283 14.891 1.00 0.00 O ATOM 1252 CB SER A 83 -8.051 10.727 12.617 1.00 0.00 C ATOM 1253 OG SER A 83 -9.259 9.984 12.473 1.00 0.00 O ATOM 0 H SER A 83 -9.103 11.118 14.853 1.00 0.00 H new ATOM 0 HA SER A 83 -7.019 9.387 13.919 1.00 0.00 H new ATOM 0 HB2 SER A 83 -8.272 11.793 12.558 1.00 0.00 H new ATOM 0 HB3 SER A 83 -7.381 10.494 11.789 1.00 0.00 H new ATOM 0 HG SER A 83 -9.697 9.899 13.346 1.00 0.00 H new ATOM 1259 N LEU A 84 -5.078 11.004 13.370 1.00 0.00 N ATOM 1260 CA LEU A 84 -3.849 11.776 13.429 1.00 0.00 C ATOM 1261 C LEU A 84 -3.108 11.651 12.096 1.00 0.00 C ATOM 1262 O LEU A 84 -3.571 10.963 11.188 1.00 0.00 O ATOM 1263 CB LEU A 84 -3.011 11.358 14.640 1.00 0.00 C ATOM 1264 CG LEU A 84 -2.051 10.187 14.418 1.00 0.00 C ATOM 1265 CD1 LEU A 84 -0.609 10.680 14.278 1.00 0.00 C ATOM 1266 CD2 LEU A 84 -2.195 9.143 15.527 1.00 0.00 C ATOM 0 H LEU A 84 -5.055 10.214 12.725 1.00 0.00 H new ATOM 0 HA LEU A 84 -4.070 12.834 13.573 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -2.431 12.220 14.971 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -3.688 11.098 15.454 1.00 0.00 H new ATOM 0 HG LEU A 84 -2.317 9.699 13.480 1.00 0.00 H new ATOM 0 HD11 LEU A 84 0.053 9.828 14.121 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -0.537 11.357 13.427 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -0.315 11.206 15.186 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -1.502 8.322 15.346 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -1.970 9.602 16.490 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -3.216 8.761 15.537 1.00 0.00 H new ATOM 1278 N TRP A 85 -1.971 12.327 12.022 1.00 0.00 N ATOM 1279 CA TRP A 85 -1.163 12.301 10.815 1.00 0.00 C ATOM 1280 C TRP A 85 0.227 12.835 11.166 1.00 0.00 C ATOM 1281 O TRP A 85 0.353 13.903 11.764 1.00 0.00 O ATOM 1282 CB TRP A 85 -1.837 13.083 9.686 1.00 0.00 C ATOM 1283 CG TRP A 85 -1.400 14.546 9.595 1.00 0.00 C ATOM 1284 CD1 TRP A 85 -1.922 15.604 10.231 1.00 0.00 C ATOM 1285 CD2 TRP A 85 -0.323 15.074 8.793 1.00 0.00 C ATOM 1286 NE1 TRP A 85 -1.263 16.770 9.899 1.00 0.00 N ATOM 1287 CE2 TRP A 85 -0.260 16.437 8.996 1.00 0.00 C ATOM 1288 CE3 TRP A 85 0.569 14.421 7.924 1.00 0.00 C ATOM 1289 CZ2 TRP A 85 0.678 17.264 8.366 1.00 0.00 C ATOM 1290 CZ3 TRP A 85 1.500 15.261 7.302 1.00 0.00 C ATOM 1291 CH2 TRP A 85 1.577 16.635 7.496 1.00 0.00 C ATOM 0 H TRP A 85 -1.590 12.896 12.778 1.00 0.00 H new ATOM 0 HA TRP A 85 -1.061 11.282 10.441 1.00 0.00 H new ATOM 0 HB2 TRP A 85 -1.621 12.591 8.738 1.00 0.00 H new ATOM 0 HB3 TRP A 85 -2.917 13.045 9.826 1.00 0.00 H new ATOM 0 HD1 TRP A 85 -2.754 15.551 10.917 1.00 0.00 H new ATOM 0 HE1 TRP A 85 -1.473 17.704 10.251 1.00 0.00 H new ATOM 0 HE3 TRP A 85 0.538 13.356 7.750 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 0.707 18.329 8.542 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 2.209 14.809 6.623 1.00 0.00 H new ATOM 0 HH2 TRP A 85 2.327 17.215 6.978 1.00 0.00 H new ATOM 1302 N SER A 86 1.236 12.069 10.778 1.00 0.00 N ATOM 1303 CA SER A 86 2.612 12.452 11.044 1.00 0.00 C ATOM 1304 C SER A 86 3.411 12.472 9.740 1.00 0.00 C ATOM 1305 O SER A 86 3.247 11.594 8.894 1.00 0.00 O ATOM 1306 CB SER A 86 3.264 11.503 12.052 1.00 0.00 C ATOM 1307 OG SER A 86 2.830 11.759 13.385 1.00 0.00 O ATOM 0 H SER A 86 1.128 11.185 10.281 1.00 0.00 H new ATOM 0 HA SER A 86 2.610 13.452 11.477 1.00 0.00 H new ATOM 0 HB2 SER A 86 3.027 10.473 11.785 1.00 0.00 H new ATOM 0 HB3 SER A 86 4.348 11.606 11.998 1.00 0.00 H new ATOM 0 HG SER A 86 3.267 11.132 13.998 1.00 0.00 H new ATOM 1313 N LEU A 87 4.260 13.482 9.618 1.00 0.00 N ATOM 1314 CA LEU A 87 5.085 13.627 8.431 1.00 0.00 C ATOM 1315 C LEU A 87 6.512 13.175 8.748 1.00 0.00 C ATOM 1316 O LEU A 87 7.030 13.455 9.829 1.00 0.00 O ATOM 1317 CB LEU A 87 4.999 15.056 7.890 1.00 0.00 C ATOM 1318 CG LEU A 87 6.040 15.438 6.836 1.00 0.00 C ATOM 1319 CD1 LEU A 87 7.367 15.825 7.492 1.00 0.00 C ATOM 1320 CD2 LEU A 87 6.215 14.320 5.807 1.00 0.00 C ATOM 0 H LEU A 87 4.394 14.208 10.322 1.00 0.00 H new ATOM 0 HA LEU A 87 4.717 12.985 7.631 1.00 0.00 H new ATOM 0 HB2 LEU A 87 4.007 15.202 7.462 1.00 0.00 H new ATOM 0 HB3 LEU A 87 5.089 15.747 8.728 1.00 0.00 H new ATOM 0 HG LEU A 87 5.677 16.315 6.300 1.00 0.00 H new ATOM 0 HD11 LEU A 87 8.090 16.092 6.721 1.00 0.00 H new ATOM 0 HD12 LEU A 87 7.211 16.677 8.154 1.00 0.00 H new ATOM 0 HD13 LEU A 87 7.747 14.982 8.069 1.00 0.00 H new ATOM 0 HD21 LEU A 87 6.960 14.618 5.070 1.00 0.00 H new ATOM 0 HD22 LEU A 87 6.545 13.411 6.310 1.00 0.00 H new ATOM 0 HD23 LEU A 87 5.264 14.134 5.307 1.00 0.00 H new ATOM 1332 N GLU A 88 7.107 12.484 7.787 1.00 0.00 N ATOM 1333 CA GLU A 88 8.464 11.990 7.951 1.00 0.00 C ATOM 1334 C GLU A 88 9.377 12.582 6.875 1.00 0.00 C ATOM 1335 O GLU A 88 9.022 12.605 5.698 1.00 0.00 O ATOM 1336 CB GLU A 88 8.499 10.461 7.919 1.00 0.00 C ATOM 1337 CG GLU A 88 7.989 9.874 9.237 1.00 0.00 C ATOM 1338 CD GLU A 88 9.032 8.948 9.865 1.00 0.00 C ATOM 1339 OE1 GLU A 88 9.097 7.781 9.422 1.00 0.00 O ATOM 1340 OE2 GLU A 88 9.742 9.429 10.775 1.00 0.00 O ATOM 0 H GLU A 88 6.675 12.254 6.892 1.00 0.00 H new ATOM 0 HA GLU A 88 8.830 12.308 8.927 1.00 0.00 H new ATOM 0 HB2 GLU A 88 7.887 10.097 7.094 1.00 0.00 H new ATOM 0 HB3 GLU A 88 9.518 10.121 7.735 1.00 0.00 H new ATOM 0 HG2 GLU A 88 7.750 10.681 9.930 1.00 0.00 H new ATOM 0 HG3 GLU A 88 7.066 9.321 9.060 1.00 0.00 H new ATOM 1347 N PRO A 89 10.567 13.058 7.330 1.00 0.00 N ATOM 1348 CA PRO A 89 11.534 13.648 6.420 1.00 0.00 C ATOM 1349 C PRO A 89 12.241 12.570 5.596 1.00 0.00 C ATOM 1350 O PRO A 89 12.864 11.667 6.153 1.00 0.00 O ATOM 1351 CB PRO A 89 12.484 14.434 7.310 1.00 0.00 C ATOM 1352 CG PRO A 89 12.294 13.881 8.713 1.00 0.00 C ATOM 1353 CD PRO A 89 11.022 13.048 8.717 1.00 0.00 C ATOM 0 HA PRO A 89 11.071 14.301 5.680 1.00 0.00 H new ATOM 0 HB2 PRO A 89 13.516 14.316 6.980 1.00 0.00 H new ATOM 0 HB3 PRO A 89 12.259 15.500 7.276 1.00 0.00 H new ATOM 0 HG2 PRO A 89 13.150 13.272 9.002 1.00 0.00 H new ATOM 0 HG3 PRO A 89 12.221 14.693 9.437 1.00 0.00 H new ATOM 0 HD2 PRO A 89 11.215 12.033 9.063 1.00 0.00 H new ATOM 0 HD3 PRO A 89 10.272 13.474 9.383 1.00 0.00 H new ATOM 1361 N GLY A 90 12.121 12.699 4.283 1.00 0.00 N ATOM 1362 CA GLY A 90 12.740 11.747 3.378 1.00 0.00 C ATOM 1363 C GLY A 90 12.226 10.329 3.636 1.00 0.00 C ATOM 1364 O GLY A 90 13.013 9.394 3.769 1.00 0.00 O ATOM 0 H GLY A 90 11.604 13.449 3.824 1.00 0.00 H new ATOM 0 HA2 GLY A 90 12.530 12.031 2.347 1.00 0.00 H new ATOM 0 HA3 GLY A 90 13.823 11.773 3.502 1.00 0.00 H new ATOM 1368 N LYS A 91 10.908 10.215 3.700 1.00 0.00 N ATOM 1369 CA LYS A 91 10.279 8.928 3.941 1.00 0.00 C ATOM 1370 C LYS A 91 8.888 8.917 3.302 1.00 0.00 C ATOM 1371 O LYS A 91 8.754 8.676 2.103 1.00 0.00 O ATOM 1372 CB LYS A 91 10.270 8.606 5.437 1.00 0.00 C ATOM 1373 CG LYS A 91 11.472 7.739 5.818 1.00 0.00 C ATOM 1374 CD LYS A 91 11.047 6.290 6.061 1.00 0.00 C ATOM 1375 CE LYS A 91 11.370 5.413 4.849 1.00 0.00 C ATOM 1376 NZ LYS A 91 10.301 4.413 4.632 1.00 0.00 N ATOM 0 H LYS A 91 10.258 10.993 3.589 1.00 0.00 H new ATOM 0 HA LYS A 91 10.854 8.130 3.470 1.00 0.00 H new ATOM 0 HB2 LYS A 91 10.288 9.532 6.012 1.00 0.00 H new ATOM 0 HB3 LYS A 91 9.347 8.088 5.696 1.00 0.00 H new ATOM 0 HG2 LYS A 91 12.217 7.775 5.023 1.00 0.00 H new ATOM 0 HG3 LYS A 91 11.944 8.139 6.716 1.00 0.00 H new ATOM 0 HD2 LYS A 91 11.557 5.901 6.942 1.00 0.00 H new ATOM 0 HD3 LYS A 91 9.978 6.251 6.268 1.00 0.00 H new ATOM 0 HE2 LYS A 91 11.479 6.036 3.961 1.00 0.00 H new ATOM 0 HE3 LYS A 91 12.323 4.907 5.003 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 10.537 3.827 3.806 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 10.216 3.808 5.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 9.398 4.901 4.464 1.00 0.00 H new ATOM 1390 N CYS A 92 7.889 9.180 4.131 1.00 0.00 N ATOM 1391 CA CYS A 92 6.514 9.204 3.662 1.00 0.00 C ATOM 1392 C CYS A 92 5.662 9.926 4.707 1.00 0.00 C ATOM 1393 O CYS A 92 6.164 10.317 5.759 1.00 0.00 O ATOM 1394 CB CYS A 92 5.991 7.795 3.373 1.00 0.00 C ATOM 1395 SG CYS A 92 6.736 6.599 4.541 1.00 0.00 S ATOM 0 H CYS A 92 8.004 9.378 5.125 1.00 0.00 H new ATOM 0 HA CYS A 92 6.459 9.742 2.716 1.00 0.00 H new ATOM 0 HB2 CYS A 92 4.905 7.776 3.463 1.00 0.00 H new ATOM 0 HB3 CYS A 92 6.231 7.512 2.348 1.00 0.00 H new ATOM 0 HG CYS A 92 6.284 5.407 4.289 1.00 0.00 H new ATOM 1401 N VAL A 93 4.387 10.081 4.380 1.00 0.00 N ATOM 1402 CA VAL A 93 3.461 10.750 5.278 1.00 0.00 C ATOM 1403 C VAL A 93 2.583 9.704 5.970 1.00 0.00 C ATOM 1404 O VAL A 93 2.029 8.823 5.315 1.00 0.00 O ATOM 1405 CB VAL A 93 2.651 11.796 4.510 1.00 0.00 C ATOM 1406 CG1 VAL A 93 1.484 12.314 5.354 1.00 0.00 C ATOM 1407 CG2 VAL A 93 3.545 12.948 4.045 1.00 0.00 C ATOM 0 H VAL A 93 3.974 9.755 3.506 1.00 0.00 H new ATOM 0 HA VAL A 93 4.004 11.286 6.057 1.00 0.00 H new ATOM 0 HB VAL A 93 2.236 11.315 3.624 1.00 0.00 H new ATOM 0 HG11 VAL A 93 0.925 13.056 4.785 1.00 0.00 H new ATOM 0 HG12 VAL A 93 0.826 11.484 5.614 1.00 0.00 H new ATOM 0 HG13 VAL A 93 1.869 12.771 6.266 1.00 0.00 H new ATOM 0 HG21 VAL A 93 2.945 13.678 3.502 1.00 0.00 H new ATOM 0 HG22 VAL A 93 4.002 13.427 4.911 1.00 0.00 H new ATOM 0 HG23 VAL A 93 4.326 12.561 3.390 1.00 0.00 H new ATOM 1417 N LEU A 94 2.485 9.837 7.284 1.00 0.00 N ATOM 1418 CA LEU A 94 1.684 8.915 8.072 1.00 0.00 C ATOM 1419 C LEU A 94 0.330 9.557 8.380 1.00 0.00 C ATOM 1420 O LEU A 94 0.270 10.687 8.861 1.00 0.00 O ATOM 1421 CB LEU A 94 2.451 8.469 9.318 1.00 0.00 C ATOM 1422 CG LEU A 94 1.854 7.288 10.087 1.00 0.00 C ATOM 1423 CD1 LEU A 94 0.440 7.611 10.575 1.00 0.00 C ATOM 1424 CD2 LEU A 94 1.893 6.011 9.246 1.00 0.00 C ATOM 0 H LEU A 94 2.947 10.569 7.823 1.00 0.00 H new ATOM 0 HA LEU A 94 1.484 8.005 7.506 1.00 0.00 H new ATOM 0 HB2 LEU A 94 3.467 8.207 9.021 1.00 0.00 H new ATOM 0 HB3 LEU A 94 2.526 9.318 9.997 1.00 0.00 H new ATOM 0 HG LEU A 94 2.467 7.110 10.971 1.00 0.00 H new ATOM 0 HD11 LEU A 94 0.038 6.756 11.118 1.00 0.00 H new ATOM 0 HD12 LEU A 94 0.472 8.478 11.235 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -0.199 7.830 9.720 1.00 0.00 H new ATOM 0 HD21 LEU A 94 1.463 5.187 9.815 1.00 0.00 H new ATOM 0 HD22 LEU A 94 1.318 6.160 8.332 1.00 0.00 H new ATOM 0 HD23 LEU A 94 2.926 5.775 8.990 1.00 0.00 H new ATOM 1436 N VAL A 95 -0.724 8.808 8.090 1.00 0.00 N ATOM 1437 CA VAL A 95 -2.073 9.290 8.330 1.00 0.00 C ATOM 1438 C VAL A 95 -2.905 8.171 8.961 1.00 0.00 C ATOM 1439 O VAL A 95 -3.178 7.158 8.319 1.00 0.00 O ATOM 1440 CB VAL A 95 -2.677 9.823 7.030 1.00 0.00 C ATOM 1441 CG1 VAL A 95 -4.146 10.208 7.224 1.00 0.00 C ATOM 1442 CG2 VAL A 95 -1.868 11.005 6.493 1.00 0.00 C ATOM 0 H VAL A 95 -0.671 7.871 7.691 1.00 0.00 H new ATOM 0 HA VAL A 95 -2.062 10.123 9.033 1.00 0.00 H new ATOM 0 HB VAL A 95 -2.635 9.024 6.290 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -4.551 10.584 6.284 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -4.713 9.332 7.539 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -4.221 10.983 7.987 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -2.319 11.365 5.568 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -1.863 11.808 7.230 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -0.844 10.686 6.297 1.00 0.00 H new ATOM 1452 N ASN A 96 -3.284 8.392 10.211 1.00 0.00 N ATOM 1453 CA ASN A 96 -4.079 7.415 10.936 1.00 0.00 C ATOM 1454 C ASN A 96 -5.547 7.845 10.918 1.00 0.00 C ATOM 1455 O ASN A 96 -5.887 8.929 11.390 1.00 0.00 O ATOM 1456 CB ASN A 96 -3.633 7.317 12.396 1.00 0.00 C ATOM 1457 CG ASN A 96 -2.258 6.655 12.505 1.00 0.00 C ATOM 1458 OD1 ASN A 96 -1.316 7.207 13.050 1.00 0.00 O ATOM 1459 ND2 ASN A 96 -2.195 5.444 11.959 1.00 0.00 N ATOM 0 H ASN A 96 -3.055 9.233 10.740 1.00 0.00 H new ATOM 0 HA ASN A 96 -3.947 6.447 10.453 1.00 0.00 H new ATOM 0 HB2 ASN A 96 -3.597 8.313 12.837 1.00 0.00 H new ATOM 0 HB3 ASN A 96 -4.364 6.743 12.966 1.00 0.00 H new ATOM 0 HD21 ASN A 96 -1.320 4.920 11.981 1.00 0.00 H new ATOM 0 HD22 ASN A 96 -3.021 5.040 11.518 1.00 0.00 H new ATOM 1466 N LEU A 97 -6.379 6.973 10.368 1.00 0.00 N ATOM 1467 CA LEU A 97 -7.803 7.248 10.282 1.00 0.00 C ATOM 1468 C LEU A 97 -8.554 6.336 11.254 1.00 0.00 C ATOM 1469 O LEU A 97 -8.411 5.115 11.201 1.00 0.00 O ATOM 1470 CB LEU A 97 -8.285 7.134 8.834 1.00 0.00 C ATOM 1471 CG LEU A 97 -7.855 8.261 7.894 1.00 0.00 C ATOM 1472 CD1 LEU A 97 -8.717 8.279 6.629 1.00 0.00 C ATOM 1473 CD2 LEU A 97 -7.866 9.611 8.614 1.00 0.00 C ATOM 0 H LEU A 97 -6.094 6.075 9.977 1.00 0.00 H new ATOM 0 HA LEU A 97 -8.011 8.275 10.583 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -7.925 6.190 8.425 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -9.374 7.086 8.837 1.00 0.00 H new ATOM 0 HG LEU A 97 -6.828 8.071 7.582 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -8.390 9.090 5.978 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -8.614 7.329 6.105 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -9.761 8.431 6.902 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -7.556 10.395 7.923 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -8.872 9.823 8.975 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -7.177 9.579 9.458 1.00 0.00 H new ATOM 1485 N SER A 98 -9.338 6.963 12.119 1.00 0.00 N ATOM 1486 CA SER A 98 -10.112 6.222 13.101 1.00 0.00 C ATOM 1487 C SER A 98 -11.390 5.679 12.459 1.00 0.00 C ATOM 1488 O SER A 98 -11.845 6.196 11.440 1.00 0.00 O ATOM 1489 CB SER A 98 -10.455 7.099 14.306 1.00 0.00 C ATOM 1490 OG SER A 98 -11.109 6.361 15.335 1.00 0.00 O ATOM 0 H SER A 98 -9.454 7.976 12.160 1.00 0.00 H new ATOM 0 HA SER A 98 -9.507 5.386 13.454 1.00 0.00 H new ATOM 0 HB2 SER A 98 -9.542 7.543 14.703 1.00 0.00 H new ATOM 0 HB3 SER A 98 -11.096 7.920 13.986 1.00 0.00 H new ATOM 0 HG SER A 98 -11.310 6.956 16.087 1.00 0.00 H new ATOM 1496 N LYS A 99 -11.932 4.642 13.081 1.00 0.00 N ATOM 1497 CA LYS A 99 -13.148 4.022 12.582 1.00 0.00 C ATOM 1498 C LYS A 99 -14.347 4.563 13.363 1.00 0.00 C ATOM 1499 O LYS A 99 -14.333 4.586 14.593 1.00 0.00 O ATOM 1500 CB LYS A 99 -13.027 2.498 12.620 1.00 0.00 C ATOM 1501 CG LYS A 99 -12.527 1.954 11.280 1.00 0.00 C ATOM 1502 CD LYS A 99 -13.175 0.606 10.959 1.00 0.00 C ATOM 1503 CE LYS A 99 -12.925 0.211 9.502 1.00 0.00 C ATOM 1504 NZ LYS A 99 -14.011 -0.666 9.009 1.00 0.00 N ATOM 0 H LYS A 99 -11.551 4.216 13.926 1.00 0.00 H new ATOM 0 HA LYS A 99 -13.305 4.280 11.535 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -12.341 2.204 13.415 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -13.996 2.058 12.856 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -12.752 2.667 10.487 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -11.443 1.842 11.310 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -12.774 -0.161 11.621 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -14.247 0.660 11.146 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -12.862 1.105 8.882 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -11.968 -0.303 9.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -13.605 -1.555 8.653 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -14.670 -0.874 9.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -14.523 -0.187 8.241 1.00 0.00 H new ATOM 1518 N VAL A 100 -15.357 4.985 12.617 1.00 0.00 N ATOM 1519 CA VAL A 100 -16.562 5.524 13.224 1.00 0.00 C ATOM 1520 C VAL A 100 -17.719 4.547 13.006 1.00 0.00 C ATOM 1521 O VAL A 100 -18.317 4.517 11.931 1.00 0.00 O ATOM 1522 CB VAL A 100 -16.847 6.922 12.669 1.00 0.00 C ATOM 1523 CG1 VAL A 100 -18.331 7.271 12.800 1.00 0.00 C ATOM 1524 CG2 VAL A 100 -15.973 7.973 13.356 1.00 0.00 C ATOM 0 H VAL A 100 -15.366 4.965 11.597 1.00 0.00 H new ATOM 0 HA VAL A 100 -16.430 5.636 14.300 1.00 0.00 H new ATOM 0 HB VAL A 100 -16.596 6.920 11.608 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -18.507 8.269 12.399 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -18.926 6.546 12.244 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -18.619 7.247 13.851 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -16.195 8.957 12.943 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -16.178 7.974 14.426 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -14.922 7.738 13.188 1.00 0.00 H new ATOM 1534 N GLY A 101 -18.000 3.772 14.042 1.00 0.00 N ATOM 1535 CA GLY A 101 -19.075 2.796 13.978 1.00 0.00 C ATOM 1536 C GLY A 101 -18.713 1.643 13.039 1.00 0.00 C ATOM 1537 O GLY A 101 -17.909 1.813 12.123 1.00 0.00 O ATOM 0 H GLY A 101 -17.502 3.800 14.932 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -19.278 2.407 14.976 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -19.989 3.278 13.632 1.00 0.00 H new ATOM 1541 N GLU A 102 -19.323 0.496 13.299 1.00 0.00 N ATOM 1542 CA GLU A 102 -19.075 -0.684 12.489 1.00 0.00 C ATOM 1543 C GLU A 102 -19.631 -0.485 11.077 1.00 0.00 C ATOM 1544 O GLU A 102 -20.806 -0.746 10.826 1.00 0.00 O ATOM 1545 CB GLU A 102 -19.672 -1.932 13.142 1.00 0.00 C ATOM 1546 CG GLU A 102 -18.860 -2.351 14.369 1.00 0.00 C ATOM 1547 CD GLU A 102 -19.202 -3.781 14.791 1.00 0.00 C ATOM 1548 OE1 GLU A 102 -18.672 -4.707 14.140 1.00 0.00 O ATOM 1549 OE2 GLU A 102 -19.985 -3.916 15.755 1.00 0.00 O ATOM 0 H GLU A 102 -19.989 0.359 14.060 1.00 0.00 H new ATOM 0 HA GLU A 102 -17.997 -0.832 12.417 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -20.704 -1.736 13.434 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -19.695 -2.749 12.420 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -17.795 -2.278 14.147 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -19.061 -1.667 15.193 1.00 0.00 H new ATOM 1556 N TYR A 103 -18.759 -0.025 10.192 1.00 0.00 N ATOM 1557 CA TYR A 103 -19.147 0.212 8.812 1.00 0.00 C ATOM 1558 C TYR A 103 -18.162 -0.447 7.845 1.00 0.00 C ATOM 1559 O TYR A 103 -17.007 -0.685 8.195 1.00 0.00 O ATOM 1560 CB TYR A 103 -19.099 1.729 8.615 1.00 0.00 C ATOM 1561 CG TYR A 103 -20.390 2.449 9.010 1.00 0.00 C ATOM 1562 CD1 TYR A 103 -21.468 2.455 8.148 1.00 0.00 C ATOM 1563 CD2 TYR A 103 -20.477 3.092 10.228 1.00 0.00 C ATOM 1564 CE1 TYR A 103 -22.683 3.133 8.519 1.00 0.00 C ATOM 1565 CE2 TYR A 103 -21.692 3.770 10.599 1.00 0.00 C ATOM 1566 CZ TYR A 103 -22.735 3.757 9.727 1.00 0.00 C ATOM 1567 OH TYR A 103 -23.882 4.397 10.077 1.00 0.00 O ATOM 0 H TYR A 103 -17.785 0.190 10.404 1.00 0.00 H new ATOM 0 HA TYR A 103 -20.135 -0.204 8.614 1.00 0.00 H new ATOM 0 HB2 TYR A 103 -18.275 2.135 9.201 1.00 0.00 H new ATOM 0 HB3 TYR A 103 -18.882 1.942 7.568 1.00 0.00 H new ATOM 0 HD1 TYR A 103 -21.400 1.951 7.195 1.00 0.00 H new ATOM 0 HD2 TYR A 103 -19.634 3.087 10.903 1.00 0.00 H new ATOM 0 HE1 TYR A 103 -23.534 3.146 7.854 1.00 0.00 H new ATOM 0 HE2 TYR A 103 -21.773 4.278 11.549 1.00 0.00 H new ATOM 0 HH TYR A 103 -23.776 4.796 10.966 1.00 0.00 H new ATOM 1577 N TRP A 104 -18.656 -0.725 6.647 1.00 0.00 N ATOM 1578 CA TRP A 104 -17.834 -1.352 5.626 1.00 0.00 C ATOM 1579 C TRP A 104 -16.951 -0.271 4.999 1.00 0.00 C ATOM 1580 O TRP A 104 -17.305 0.907 5.009 1.00 0.00 O ATOM 1581 CB TRP A 104 -18.699 -2.087 4.600 1.00 0.00 C ATOM 1582 CG TRP A 104 -18.070 -2.181 3.209 1.00 0.00 C ATOM 1583 CD1 TRP A 104 -17.608 -3.274 2.585 1.00 0.00 C ATOM 1584 CD2 TRP A 104 -17.851 -1.092 2.288 1.00 0.00 C ATOM 1585 NE1 TRP A 104 -17.109 -2.969 1.335 1.00 0.00 N ATOM 1586 CE2 TRP A 104 -17.261 -1.600 1.149 1.00 0.00 C ATOM 1587 CE3 TRP A 104 -18.141 0.278 2.414 1.00 0.00 C ATOM 1588 CZ2 TRP A 104 -16.912 -0.809 0.048 1.00 0.00 C ATOM 1589 CZ3 TRP A 104 -17.786 1.056 1.306 1.00 0.00 C ATOM 1590 CH2 TRP A 104 -17.192 0.559 0.151 1.00 0.00 C ATOM 0 H TRP A 104 -19.615 -0.528 6.361 1.00 0.00 H new ATOM 0 HA TRP A 104 -17.191 -2.115 6.064 1.00 0.00 H new ATOM 0 HB2 TRP A 104 -18.901 -3.094 4.965 1.00 0.00 H new ATOM 0 HB3 TRP A 104 -19.660 -1.579 4.519 1.00 0.00 H new ATOM 0 HD1 TRP A 104 -17.624 -4.268 3.007 1.00 0.00 H new ATOM 0 HE1 TRP A 104 -16.703 -3.627 0.670 1.00 0.00 H new ATOM 0 HE3 TRP A 104 -18.602 0.697 3.296 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 -16.452 -1.231 -0.833 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 -17.987 2.116 1.351 1.00 0.00 H new ATOM 0 HH2 TRP A 104 -16.948 1.225 -0.663 1.00 0.00 H new ATOM 1601 N TRP A 105 -15.820 -0.710 4.468 1.00 0.00 N ATOM 1602 CA TRP A 105 -14.884 0.205 3.837 1.00 0.00 C ATOM 1603 C TRP A 105 -14.422 -0.423 2.521 1.00 0.00 C ATOM 1604 O TRP A 105 -14.824 0.016 1.445 1.00 0.00 O ATOM 1605 CB TRP A 105 -13.725 0.540 4.779 1.00 0.00 C ATOM 1606 CG TRP A 105 -13.993 1.736 5.695 1.00 0.00 C ATOM 1607 CD1 TRP A 105 -14.841 1.810 6.730 1.00 0.00 C ATOM 1608 CD2 TRP A 105 -13.371 3.036 5.614 1.00 0.00 C ATOM 1609 NE1 TRP A 105 -14.811 3.057 7.320 1.00 0.00 N ATOM 1610 CE2 TRP A 105 -13.889 3.826 6.620 1.00 0.00 C ATOM 1611 CE3 TRP A 105 -12.403 3.528 4.721 1.00 0.00 C ATOM 1612 CZ2 TRP A 105 -13.500 5.155 6.829 1.00 0.00 C ATOM 1613 CZ3 TRP A 105 -12.025 4.857 4.943 1.00 0.00 C ATOM 1614 CH2 TRP A 105 -12.536 5.666 5.951 1.00 0.00 C ATOM 0 H TRP A 105 -15.530 -1.688 4.462 1.00 0.00 H new ATOM 0 HA TRP A 105 -15.366 1.158 3.617 1.00 0.00 H new ATOM 0 HB2 TRP A 105 -13.506 -0.333 5.393 1.00 0.00 H new ATOM 0 HB3 TRP A 105 -12.834 0.743 4.185 1.00 0.00 H new ATOM 0 HD1 TRP A 105 -15.469 0.996 7.061 1.00 0.00 H new ATOM 0 HE1 TRP A 105 -15.364 3.359 8.122 1.00 0.00 H new ATOM 0 HE3 TRP A 105 -11.984 2.928 3.927 1.00 0.00 H new ATOM 0 HZ2 TRP A 105 -13.920 5.753 7.624 1.00 0.00 H new ATOM 0 HZ3 TRP A 105 -11.284 5.284 4.284 1.00 0.00 H new ATOM 0 HH2 TRP A 105 -12.191 6.684 6.057 1.00 0.00 H new ATOM 1625 N ASN A 106 -13.584 -1.441 2.650 1.00 0.00 N ATOM 1626 CA ASN A 106 -13.062 -2.134 1.484 1.00 0.00 C ATOM 1627 C ASN A 106 -12.497 -1.110 0.498 1.00 0.00 C ATOM 1628 O ASN A 106 -12.387 -1.387 -0.695 1.00 0.00 O ATOM 1629 CB ASN A 106 -14.166 -2.918 0.771 1.00 0.00 C ATOM 1630 CG ASN A 106 -14.572 -4.152 1.579 1.00 0.00 C ATOM 1631 OD1 ASN A 106 -14.556 -5.273 1.099 1.00 0.00 O ATOM 1632 ND2 ASN A 106 -14.936 -3.884 2.830 1.00 0.00 N ATOM 0 H ASN A 106 -13.253 -1.803 3.544 1.00 0.00 H new ATOM 0 HA ASN A 106 -12.288 -2.824 1.820 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -15.034 -2.276 0.621 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -13.820 -3.223 -0.217 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -15.225 -4.640 3.450 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -14.927 -2.922 3.169 1.00 0.00 H new ATOM 1639 N ALA A 107 -12.153 0.052 1.034 1.00 0.00 N ATOM 1640 CA ALA A 107 -11.601 1.119 0.216 1.00 0.00 C ATOM 1641 C ALA A 107 -11.645 2.432 1.000 1.00 0.00 C ATOM 1642 O ALA A 107 -12.594 2.685 1.741 1.00 0.00 O ATOM 1643 CB ALA A 107 -12.371 1.201 -1.103 1.00 0.00 C ATOM 0 H ALA A 107 -12.246 0.278 2.024 1.00 0.00 H new ATOM 0 HA ALA A 107 -10.558 0.916 -0.027 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -11.957 2.001 -1.717 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -12.284 0.254 -1.635 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -13.422 1.407 -0.899 1.00 0.00 H new ATOM 1649 N ILE A 108 -10.607 3.232 0.811 1.00 0.00 N ATOM 1650 CA ILE A 108 -10.515 4.513 1.491 1.00 0.00 C ATOM 1651 C ILE A 108 -11.435 5.520 0.799 1.00 0.00 C ATOM 1652 O ILE A 108 -12.343 6.068 1.423 1.00 0.00 O ATOM 1653 CB ILE A 108 -9.057 4.970 1.578 1.00 0.00 C ATOM 1654 CG1 ILE A 108 -8.168 3.863 2.148 1.00 0.00 C ATOM 1655 CG2 ILE A 108 -8.937 6.270 2.376 1.00 0.00 C ATOM 1656 CD1 ILE A 108 -8.107 3.942 3.675 1.00 0.00 C ATOM 0 H ILE A 108 -9.822 3.018 0.196 1.00 0.00 H new ATOM 0 HA ILE A 108 -10.859 4.423 2.522 1.00 0.00 H new ATOM 0 HB ILE A 108 -8.703 5.178 0.568 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -8.554 2.890 1.846 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -7.163 3.950 1.735 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -7.891 6.573 2.423 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -9.520 7.051 1.888 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -9.315 6.113 3.386 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -7.469 3.144 4.055 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -7.698 4.907 3.973 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -9.111 3.831 4.085 1.00 0.00 H new ATOM 1668 N LEU A 109 -11.170 5.734 -0.481 1.00 0.00 N ATOM 1669 CA LEU A 109 -11.963 6.666 -1.265 1.00 0.00 C ATOM 1670 C LEU A 109 -13.039 5.894 -2.030 1.00 0.00 C ATOM 1671 O LEU A 109 -12.959 4.674 -2.161 1.00 0.00 O ATOM 1672 CB LEU A 109 -11.060 7.516 -2.161 1.00 0.00 C ATOM 1673 CG LEU A 109 -9.936 8.275 -1.454 1.00 0.00 C ATOM 1674 CD1 LEU A 109 -9.086 9.056 -2.458 1.00 0.00 C ATOM 1675 CD2 LEU A 109 -10.492 9.177 -0.351 1.00 0.00 C ATOM 0 H LEU A 109 -10.417 5.278 -0.995 1.00 0.00 H new ATOM 0 HA LEU A 109 -12.479 7.371 -0.613 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -10.615 6.867 -2.915 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -11.682 8.238 -2.690 1.00 0.00 H new ATOM 0 HG LEU A 109 -9.282 7.547 -0.975 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -8.294 9.587 -1.929 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -8.643 8.365 -3.175 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -9.714 9.774 -2.986 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -9.672 9.705 0.135 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -11.182 9.900 -0.786 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -11.019 8.569 0.385 1.00 0.00 H new ATOM 1687 N GLU A 110 -14.022 6.638 -2.517 1.00 0.00 N ATOM 1688 CA GLU A 110 -15.113 6.039 -3.267 1.00 0.00 C ATOM 1689 C GLU A 110 -14.635 5.624 -4.660 1.00 0.00 C ATOM 1690 O GLU A 110 -13.665 6.176 -5.177 1.00 0.00 O ATOM 1691 CB GLU A 110 -16.305 6.994 -3.358 1.00 0.00 C ATOM 1692 CG GLU A 110 -17.329 6.699 -2.260 1.00 0.00 C ATOM 1693 CD GLU A 110 -18.604 6.091 -2.849 1.00 0.00 C ATOM 1694 OE1 GLU A 110 -19.109 6.674 -3.832 1.00 0.00 O ATOM 1695 OE2 GLU A 110 -19.045 5.057 -2.302 1.00 0.00 O ATOM 0 H GLU A 110 -14.085 7.650 -2.407 1.00 0.00 H new ATOM 0 HA GLU A 110 -15.445 5.146 -2.737 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -15.958 8.024 -3.270 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -16.777 6.900 -4.336 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -16.898 6.013 -1.530 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -17.572 7.619 -1.728 1.00 0.00 H new ATOM 1702 N GLY A 111 -15.339 4.656 -5.228 1.00 0.00 N ATOM 1703 CA GLY A 111 -14.999 4.161 -6.551 1.00 0.00 C ATOM 1704 C GLY A 111 -13.945 3.055 -6.468 1.00 0.00 C ATOM 1705 O GLY A 111 -14.098 2.000 -7.083 1.00 0.00 O ATOM 0 H GLY A 111 -16.143 4.201 -4.796 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -15.894 3.779 -7.042 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -14.624 4.980 -7.165 1.00 0.00 H new ATOM 1709 N GLU A 112 -12.900 3.333 -5.704 1.00 0.00 N ATOM 1710 CA GLU A 112 -11.821 2.375 -5.533 1.00 0.00 C ATOM 1711 C GLU A 112 -12.388 0.968 -5.337 1.00 0.00 C ATOM 1712 O GLU A 112 -13.035 0.690 -4.328 1.00 0.00 O ATOM 1713 CB GLU A 112 -10.917 2.770 -4.363 1.00 0.00 C ATOM 1714 CG GLU A 112 -9.518 2.173 -4.526 1.00 0.00 C ATOM 1715 CD GLU A 112 -8.502 3.253 -4.903 1.00 0.00 C ATOM 1716 OE1 GLU A 112 -8.631 3.787 -6.026 1.00 0.00 O ATOM 1717 OE2 GLU A 112 -7.618 3.520 -4.061 1.00 0.00 O ATOM 0 H GLU A 112 -12.777 4.209 -5.196 1.00 0.00 H new ATOM 0 HA GLU A 112 -11.212 2.378 -6.437 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -10.848 3.856 -4.302 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -11.356 2.426 -3.427 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -9.214 1.691 -3.597 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -9.536 1.401 -5.295 1.00 0.00 H new ATOM 1724 N GLU A 113 -12.124 0.116 -6.317 1.00 0.00 N ATOM 1725 CA GLU A 113 -12.599 -1.256 -6.265 1.00 0.00 C ATOM 1726 C GLU A 113 -12.487 -1.803 -4.841 1.00 0.00 C ATOM 1727 O GLU A 113 -11.596 -1.410 -4.089 1.00 0.00 O ATOM 1728 CB GLU A 113 -11.835 -2.139 -7.253 1.00 0.00 C ATOM 1729 CG GLU A 113 -12.346 -1.934 -8.681 1.00 0.00 C ATOM 1730 CD GLU A 113 -11.207 -1.530 -9.619 1.00 0.00 C ATOM 1731 OE1 GLU A 113 -10.296 -2.367 -9.800 1.00 0.00 O ATOM 1732 OE2 GLU A 113 -11.272 -0.393 -10.134 1.00 0.00 O ATOM 0 H GLU A 113 -11.587 0.350 -7.152 1.00 0.00 H new ATOM 0 HA GLU A 113 -13.649 -1.267 -6.556 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -10.771 -1.906 -7.207 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -11.945 -3.186 -6.971 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -12.809 -2.853 -9.041 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -13.118 -1.164 -8.688 1.00 0.00 H new ATOM 1739 N PRO A 114 -13.427 -2.726 -4.504 1.00 0.00 N ATOM 1740 CA PRO A 114 -13.442 -3.331 -3.183 1.00 0.00 C ATOM 1741 C PRO A 114 -12.325 -4.367 -3.041 1.00 0.00 C ATOM 1742 O PRO A 114 -12.159 -5.227 -3.905 1.00 0.00 O ATOM 1743 CB PRO A 114 -14.831 -3.932 -3.041 1.00 0.00 C ATOM 1744 CG PRO A 114 -15.381 -4.048 -4.453 1.00 0.00 C ATOM 1745 CD PRO A 114 -14.497 -3.216 -5.368 1.00 0.00 C ATOM 0 HA PRO A 114 -13.251 -2.610 -2.388 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -14.787 -4.908 -2.558 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -15.469 -3.299 -2.424 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -15.390 -5.089 -4.775 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -16.411 -3.693 -4.492 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -14.101 -3.815 -6.188 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -15.054 -2.392 -5.815 1.00 0.00 H new ATOM 1753 N ILE A 115 -11.589 -4.250 -1.946 1.00 0.00 N ATOM 1754 CA ILE A 115 -10.492 -5.166 -1.681 1.00 0.00 C ATOM 1755 C ILE A 115 -11.014 -6.604 -1.717 1.00 0.00 C ATOM 1756 O ILE A 115 -12.151 -6.845 -2.121 1.00 0.00 O ATOM 1757 CB ILE A 115 -9.793 -4.799 -0.371 1.00 0.00 C ATOM 1758 CG1 ILE A 115 -10.749 -4.928 0.816 1.00 0.00 C ATOM 1759 CG2 ILE A 115 -9.168 -3.404 -0.455 1.00 0.00 C ATOM 1760 CD1 ILE A 115 -10.151 -4.292 2.073 1.00 0.00 C ATOM 0 H ILE A 115 -11.730 -3.535 -1.232 1.00 0.00 H new ATOM 0 HA ILE A 115 -9.731 -5.083 -2.457 1.00 0.00 H new ATOM 0 HB ILE A 115 -8.980 -5.507 -0.208 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -11.698 -4.448 0.577 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -10.963 -5.980 1.003 1.00 0.00 H new ATOM 0 HG21 ILE A 115 -8.677 -3.168 0.489 1.00 0.00 H new ATOM 0 HG22 ILE A 115 -8.434 -3.382 -1.261 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -9.947 -2.668 -0.654 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -10.851 -4.397 2.902 1.00 0.00 H new ATOM 0 HD12 ILE A 115 -9.215 -4.791 2.323 1.00 0.00 H new ATOM 0 HD13 ILE A 115 -9.961 -3.234 1.891 1.00 0.00 H new ATOM 1772 N ASP A 116 -10.159 -7.521 -1.290 1.00 0.00 N ATOM 1773 CA ASP A 116 -10.520 -8.928 -1.268 1.00 0.00 C ATOM 1774 C ASP A 116 -9.327 -9.749 -0.774 1.00 0.00 C ATOM 1775 O ASP A 116 -8.233 -9.658 -1.330 1.00 0.00 O ATOM 1776 CB ASP A 116 -10.887 -9.424 -2.668 1.00 0.00 C ATOM 1777 CG ASP A 116 -11.791 -10.659 -2.701 1.00 0.00 C ATOM 1778 OD1 ASP A 116 -12.396 -10.946 -1.646 1.00 0.00 O ATOM 1779 OD2 ASP A 116 -11.855 -11.287 -3.779 1.00 0.00 O ATOM 0 H ASP A 116 -9.217 -7.317 -0.956 1.00 0.00 H new ATOM 0 HA ASP A 116 -11.378 -9.045 -0.607 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -11.382 -8.615 -3.205 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -9.968 -9.650 -3.209 1.00 0.00 H new ATOM 1784 N ILE A 117 -9.577 -10.531 0.266 1.00 0.00 N ATOM 1785 CA ILE A 117 -8.537 -11.367 0.841 1.00 0.00 C ATOM 1786 C ILE A 117 -7.288 -10.520 1.090 1.00 0.00 C ATOM 1787 O ILE A 117 -7.284 -9.319 0.824 1.00 0.00 O ATOM 1788 CB ILE A 117 -8.284 -12.591 -0.041 1.00 0.00 C ATOM 1789 CG1 ILE A 117 -9.576 -13.055 -0.718 1.00 0.00 C ATOM 1790 CG2 ILE A 117 -7.620 -13.714 0.758 1.00 0.00 C ATOM 1791 CD1 ILE A 117 -9.601 -12.643 -2.191 1.00 0.00 C ATOM 0 H ILE A 117 -10.485 -10.603 0.725 1.00 0.00 H new ATOM 0 HA ILE A 117 -8.855 -11.760 1.807 1.00 0.00 H new ATOM 0 HB ILE A 117 -7.591 -12.305 -0.832 1.00 0.00 H new ATOM 0 HG12 ILE A 117 -9.664 -14.139 -0.638 1.00 0.00 H new ATOM 0 HG13 ILE A 117 -10.435 -12.627 -0.202 1.00 0.00 H new ATOM 0 HG21 ILE A 117 -7.451 -14.572 0.108 1.00 0.00 H new ATOM 0 HG22 ILE A 117 -6.666 -13.365 1.153 1.00 0.00 H new ATOM 0 HG23 ILE A 117 -8.269 -14.006 1.583 1.00 0.00 H new ATOM 0 HD11 ILE A 117 -10.529 -12.985 -2.649 1.00 0.00 H new ATOM 0 HD12 ILE A 117 -9.537 -11.557 -2.266 1.00 0.00 H new ATOM 0 HD13 ILE A 117 -8.754 -13.093 -2.709 1.00 0.00 H new ATOM 1803 N ASP A 118 -6.256 -11.179 1.597 1.00 0.00 N ATOM 1804 CA ASP A 118 -5.003 -10.501 1.885 1.00 0.00 C ATOM 1805 C ASP A 118 -5.255 -9.379 2.894 1.00 0.00 C ATOM 1806 O ASP A 118 -5.748 -8.312 2.530 1.00 0.00 O ATOM 1807 CB ASP A 118 -4.412 -9.876 0.620 1.00 0.00 C ATOM 1808 CG ASP A 118 -4.252 -10.835 -0.561 1.00 0.00 C ATOM 1809 OD1 ASP A 118 -3.895 -12.004 -0.299 1.00 0.00 O ATOM 1810 OD2 ASP A 118 -4.490 -10.378 -1.700 1.00 0.00 O ATOM 0 H ASP A 118 -6.262 -12.175 1.816 1.00 0.00 H new ATOM 0 HA ASP A 118 -4.305 -11.237 2.283 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -5.048 -9.046 0.311 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -3.436 -9.456 0.862 1.00 0.00 H new ATOM 1815 N SER A 119 -4.907 -9.658 4.141 1.00 0.00 N ATOM 1816 CA SER A 119 -5.089 -8.686 5.205 1.00 0.00 C ATOM 1817 C SER A 119 -4.491 -9.218 6.509 1.00 0.00 C ATOM 1818 O SER A 119 -5.086 -10.069 7.167 1.00 0.00 O ATOM 1819 CB SER A 119 -6.569 -8.351 5.398 1.00 0.00 C ATOM 1820 OG SER A 119 -6.768 -7.380 6.421 1.00 0.00 O ATOM 0 H SER A 119 -4.499 -10.544 4.439 1.00 0.00 H new ATOM 0 HA SER A 119 -4.571 -7.770 4.923 1.00 0.00 H new ATOM 0 HB2 SER A 119 -6.982 -7.979 4.460 1.00 0.00 H new ATOM 0 HB3 SER A 119 -7.116 -9.259 5.649 1.00 0.00 H new ATOM 0 HG SER A 119 -6.666 -6.481 6.043 1.00 0.00 H new ATOM 1826 N GLY A 120 -3.320 -8.694 6.842 1.00 0.00 N ATOM 1827 CA GLY A 120 -2.635 -9.106 8.055 1.00 0.00 C ATOM 1828 C GLY A 120 -1.311 -9.800 7.729 1.00 0.00 C ATOM 1829 O GLY A 120 -0.850 -9.761 6.589 1.00 0.00 O ATOM 0 H GLY A 120 -2.829 -7.988 6.293 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -2.448 -8.236 8.685 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -3.273 -9.781 8.625 1.00 0.00 H new ATOM 1833 N PRO A 121 -0.721 -10.436 8.777 1.00 0.00 N ATOM 1834 CA PRO A 121 0.540 -11.137 8.612 1.00 0.00 C ATOM 1835 C PRO A 121 0.338 -12.464 7.877 1.00 0.00 C ATOM 1836 O PRO A 121 0.470 -13.533 8.471 1.00 0.00 O ATOM 1837 CB PRO A 121 1.078 -11.316 10.023 1.00 0.00 C ATOM 1838 CG PRO A 121 -0.112 -11.126 10.949 1.00 0.00 C ATOM 1839 CD PRO A 121 -1.238 -10.502 10.140 1.00 0.00 C ATOM 0 HA PRO A 121 1.250 -10.586 7.996 1.00 0.00 H new ATOM 0 HB2 PRO A 121 1.518 -12.305 10.151 1.00 0.00 H new ATOM 0 HB3 PRO A 121 1.861 -10.588 10.238 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -0.427 -12.082 11.367 1.00 0.00 H new ATOM 0 HG3 PRO A 121 0.156 -10.484 11.788 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -2.144 -11.106 10.191 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -1.493 -9.511 10.515 1.00 0.00 H new ATOM 1847 N SER A 122 0.021 -12.351 6.596 1.00 0.00 N ATOM 1848 CA SER A 122 -0.201 -13.528 5.773 1.00 0.00 C ATOM 1849 C SER A 122 1.092 -13.914 5.052 1.00 0.00 C ATOM 1850 O SER A 122 1.813 -13.048 4.556 1.00 0.00 O ATOM 1851 CB SER A 122 -1.322 -13.289 4.760 1.00 0.00 C ATOM 1852 OG SER A 122 -1.089 -12.127 3.969 1.00 0.00 O ATOM 0 H SER A 122 -0.088 -11.462 6.107 1.00 0.00 H new ATOM 0 HA SER A 122 -0.505 -14.347 6.424 1.00 0.00 H new ATOM 0 HB2 SER A 122 -1.413 -14.158 4.109 1.00 0.00 H new ATOM 0 HB3 SER A 122 -2.270 -13.184 5.287 1.00 0.00 H new ATOM 0 HG SER A 122 -1.826 -12.010 3.334 1.00 0.00 H new ATOM 1858 N SER A 123 1.347 -15.213 5.015 1.00 0.00 N ATOM 1859 CA SER A 123 2.541 -15.724 4.362 1.00 0.00 C ATOM 1860 C SER A 123 2.316 -15.806 2.851 1.00 0.00 C ATOM 1861 O SER A 123 1.195 -16.031 2.398 1.00 0.00 O ATOM 1862 CB SER A 123 2.927 -17.096 4.917 1.00 0.00 C ATOM 1863 OG SER A 123 3.859 -17.769 4.075 1.00 0.00 O ATOM 0 H SER A 123 0.747 -15.928 5.427 1.00 0.00 H new ATOM 0 HA SER A 123 3.363 -15.037 4.563 1.00 0.00 H new ATOM 0 HB2 SER A 123 3.357 -16.977 5.911 1.00 0.00 H new ATOM 0 HB3 SER A 123 2.031 -17.707 5.028 1.00 0.00 H new ATOM 0 HG SER A 123 4.082 -18.640 4.464 1.00 0.00 H new ATOM 1869 N GLY A 124 3.401 -15.619 2.113 1.00 0.00 N ATOM 1870 CA GLY A 124 3.336 -15.669 0.662 1.00 0.00 C ATOM 1871 C GLY A 124 4.676 -15.269 0.040 1.00 0.00 C ATOM 1872 O GLY A 124 4.741 -14.943 -1.144 1.00 0.00 O ATOM 0 H GLY A 124 4.329 -15.433 2.493 1.00 0.00 H new ATOM 0 HA2 GLY A 124 3.068 -16.675 0.341 1.00 0.00 H new ATOM 0 HA3 GLY A 124 2.552 -15.001 0.306 1.00 0.00 H new TER 1876 GLY A 124