USER MOD reduce.3.24.130724 H: found=0, std=0, add=948, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 946 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 37 THR OG1 : rot -120:sc=-0.00798 USER MOD Set 1.2: A 69 THR OG1 : rot 180:sc=0.000441 USER MOD Set 2.1: A 12 MET CE :methyl -113:sc= -0.0393 (180deg=-1.04) USER MOD Set 2.2: A 68 THR OG1 : rot 130:sc= 0 USER MOD Set 3.1: A 13 TYR OH : rot 180:sc= -0.0274 USER MOD Set 3.2: A 101 LYS NZ :NH3+ -136:sc= -0.0187 (180deg=-0.0318) USER MOD Single : A 1 GLY N :NH3+ -116:sc= -0.123 (180deg=-1.09!) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 THR OG1 : rot 170:sc= -0.273 USER MOD Single : A 19 GLN : amide:sc= -0.752 X(o=-0.75,f=-1.1!) USER MOD Single : A 20 SER OG : rot 180:sc= -0.0906 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ -113:sc= 1.93 (180deg=-1.67) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= 0.652 K(o=0.65,f=-2.7!) USER MOD Single : A 38 GLN : amide:sc= -0.487 X(o=-0.49,f=-0.016) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 180:sc= 0.085 USER MOD Single : A 50 SER OG : rot 90:sc= 0.00504 USER MOD Single : A 55 SER OG : rot 125:sc= 1.36 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 THR OG1 : rot 180:sc= -0.237 USER MOD Single : A 67 SER OG : rot 180:sc=-0.00292 USER MOD Single : A 71 LYS NZ :NH3+ 156:sc= -0.104 (180deg=-0.35) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 90 ASN : amide:sc= -0.521 K(o=-0.52,f=-2.5!) USER MOD Single : A 93 MET CE :methyl 179:sc= -4.22! (180deg=-4.34!) USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 ASN : amide:sc= -0.511 X(o=-0.51,f=-0.048) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ 177:sc= 2.93 (180deg=2.87) USER MOD Single : A 120 SER OG : rot 51:sc= 0.154 USER MOD Single : A 121 THR OG1 : rot 62:sc= 1.22 USER MOD Single : A 125 ASN : amide:sc= 0.334 X(o=0.33,f=0) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 TYR OH : rot 5:sc= 1.23 USER MOD Single : A 129 ASN : amide:sc= 0 X(o=0,f=-0.22) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 42.698 -10.784 -8.386 1.00 0.00 N ATOM 2 CA GLY A 1 42.540 -9.838 -9.503 1.00 0.00 C ATOM 3 C GLY A 1 41.239 -9.122 -9.252 1.00 0.00 C ATOM 4 O GLY A 1 40.201 -9.778 -9.263 1.00 0.00 O ATOM 0 H1 GLY A 1 43.536 -10.525 -7.828 1.00 0.00 H new ATOM 0 H2 GLY A 1 41.854 -10.749 -7.780 1.00 0.00 H new ATOM 0 H3 GLY A 1 42.816 -11.747 -8.761 1.00 0.00 H new ATOM 0 HA2 GLY A 1 43.372 -9.135 -9.541 1.00 0.00 H new ATOM 0 HA3 GLY A 1 42.521 -10.361 -10.459 1.00 0.00 H new ATOM 8 N ASP A 2 41.316 -7.847 -8.885 1.00 0.00 N ATOM 9 CA ASP A 2 40.509 -7.283 -7.809 1.00 0.00 C ATOM 10 C ASP A 2 40.376 -5.819 -8.211 1.00 0.00 C ATOM 11 O ASP A 2 41.397 -5.141 -8.301 1.00 0.00 O ATOM 12 CB ASP A 2 41.211 -7.446 -6.427 1.00 0.00 C ATOM 13 CG ASP A 2 42.045 -8.728 -6.302 1.00 0.00 C ATOM 14 OD1 ASP A 2 41.477 -9.826 -6.116 1.00 0.00 O ATOM 15 OD2 ASP A 2 43.247 -8.727 -6.664 1.00 0.00 O ATOM 0 H ASP A 2 41.942 -7.174 -9.327 1.00 0.00 H new ATOM 0 HA ASP A 2 39.545 -7.777 -7.688 1.00 0.00 H new ATOM 0 HB2 ASP A 2 41.857 -6.585 -6.255 1.00 0.00 H new ATOM 0 HB3 ASP A 2 40.454 -7.438 -5.643 1.00 0.00 H new ATOM 20 N ASP A 3 39.182 -5.407 -8.621 1.00 0.00 N ATOM 21 CA ASP A 3 38.868 -4.180 -9.343 1.00 0.00 C ATOM 22 C ASP A 3 37.372 -3.938 -9.105 1.00 0.00 C ATOM 23 O ASP A 3 36.590 -4.881 -9.290 1.00 0.00 O ATOM 24 CB ASP A 3 39.171 -4.413 -10.836 1.00 0.00 C ATOM 25 CG ASP A 3 38.926 -3.192 -11.721 1.00 0.00 C ATOM 26 OD1 ASP A 3 39.275 -2.076 -11.282 1.00 0.00 O ATOM 27 OD2 ASP A 3 38.515 -3.406 -12.885 1.00 0.00 O ATOM 0 H ASP A 3 38.346 -5.964 -8.444 1.00 0.00 H new ATOM 0 HA ASP A 3 39.449 -3.318 -9.014 1.00 0.00 H new ATOM 0 HB2 ASP A 3 40.211 -4.721 -10.941 1.00 0.00 H new ATOM 0 HB3 ASP A 3 38.556 -5.238 -11.196 1.00 0.00 H new ATOM 32 N ASP A 4 36.966 -2.760 -8.605 1.00 0.00 N ATOM 33 CA ASP A 4 35.567 -2.460 -8.263 1.00 0.00 C ATOM 34 C ASP A 4 35.273 -0.949 -8.299 1.00 0.00 C ATOM 35 O ASP A 4 36.188 -0.130 -8.367 1.00 0.00 O ATOM 36 CB ASP A 4 35.150 -3.113 -6.919 1.00 0.00 C ATOM 37 CG ASP A 4 35.067 -2.177 -5.700 1.00 0.00 C ATOM 38 OD1 ASP A 4 36.125 -1.834 -5.131 1.00 0.00 O ATOM 39 OD2 ASP A 4 33.917 -1.881 -5.293 1.00 0.00 O ATOM 0 H ASP A 4 37.604 -1.984 -8.426 1.00 0.00 H new ATOM 0 HA ASP A 4 34.945 -2.911 -9.036 1.00 0.00 H new ATOM 0 HB2 ASP A 4 34.176 -3.583 -7.055 1.00 0.00 H new ATOM 0 HB3 ASP A 4 35.859 -3.909 -6.691 1.00 0.00 H new ATOM 44 N GLU A 5 33.986 -0.578 -8.276 1.00 0.00 N ATOM 45 CA GLU A 5 33.493 0.797 -8.306 1.00 0.00 C ATOM 46 C GLU A 5 32.109 0.808 -7.631 1.00 0.00 C ATOM 47 O GLU A 5 31.098 0.505 -8.278 1.00 0.00 O ATOM 48 CB GLU A 5 33.523 1.466 -9.702 1.00 0.00 C ATOM 49 CG GLU A 5 32.616 0.922 -10.828 1.00 0.00 C ATOM 50 CD GLU A 5 31.256 1.637 -11.019 1.00 0.00 C ATOM 51 OE1 GLU A 5 31.077 2.836 -10.676 1.00 0.00 O ATOM 52 OE2 GLU A 5 30.351 1.006 -11.628 1.00 0.00 O ATOM 0 H GLU A 5 33.230 -1.262 -8.234 1.00 0.00 H new ATOM 0 HA GLU A 5 34.179 1.432 -7.746 1.00 0.00 H new ATOM 0 HB2 GLU A 5 33.276 2.519 -9.565 1.00 0.00 H new ATOM 0 HB3 GLU A 5 34.551 1.424 -10.062 1.00 0.00 H new ATOM 0 HG2 GLU A 5 33.166 0.977 -11.767 1.00 0.00 H new ATOM 0 HG3 GLU A 5 32.423 -0.133 -10.633 1.00 0.00 H new ATOM 59 N PRO A 6 32.033 0.960 -6.295 1.00 0.00 N ATOM 60 CA PRO A 6 30.813 0.720 -5.527 1.00 0.00 C ATOM 61 C PRO A 6 29.870 1.920 -5.614 1.00 0.00 C ATOM 62 O PRO A 6 29.547 2.590 -4.627 1.00 0.00 O ATOM 63 CB PRO A 6 31.338 0.481 -4.117 1.00 0.00 C ATOM 64 CG PRO A 6 32.544 1.411 -4.008 1.00 0.00 C ATOM 65 CD PRO A 6 33.132 1.339 -5.415 1.00 0.00 C ATOM 0 HA PRO A 6 30.218 -0.118 -5.890 1.00 0.00 H new ATOM 0 HB2 PRO A 6 30.584 0.716 -3.366 1.00 0.00 H new ATOM 0 HB3 PRO A 6 31.623 -0.561 -3.969 1.00 0.00 H new ATOM 0 HG2 PRO A 6 32.253 2.426 -3.740 1.00 0.00 H new ATOM 0 HG3 PRO A 6 33.253 1.072 -3.252 1.00 0.00 H new ATOM 0 HD2 PRO A 6 33.554 2.300 -5.710 1.00 0.00 H new ATOM 0 HD3 PRO A 6 33.939 0.608 -5.463 1.00 0.00 H new ATOM 73 N GLY A 7 29.398 2.201 -6.819 1.00 0.00 N ATOM 74 CA GLY A 7 29.094 3.566 -7.178 1.00 0.00 C ATOM 75 C GLY A 7 27.661 4.009 -6.890 1.00 0.00 C ATOM 76 O GLY A 7 27.314 5.162 -7.173 1.00 0.00 O ATOM 0 H GLY A 7 29.222 1.511 -7.549 1.00 0.00 H new ATOM 0 HA2 GLY A 7 29.776 4.226 -6.643 1.00 0.00 H new ATOM 0 HA3 GLY A 7 29.292 3.698 -8.242 1.00 0.00 H new ATOM 80 N GLY A 8 26.836 3.134 -6.311 1.00 0.00 N ATOM 81 CA GLY A 8 25.417 3.351 -6.111 1.00 0.00 C ATOM 82 C GLY A 8 25.079 3.334 -4.630 1.00 0.00 C ATOM 83 O GLY A 8 25.741 2.668 -3.820 1.00 0.00 O ATOM 0 H GLY A 8 27.155 2.231 -5.961 1.00 0.00 H new ATOM 0 HA2 GLY A 8 25.125 4.307 -6.546 1.00 0.00 H new ATOM 0 HA3 GLY A 8 24.849 2.578 -6.629 1.00 0.00 H new ATOM 87 N LYS A 9 23.992 4.013 -4.275 1.00 0.00 N ATOM 88 CA LYS A 9 23.463 4.238 -2.951 1.00 0.00 C ATOM 89 C LYS A 9 21.958 4.441 -3.139 1.00 0.00 C ATOM 90 O LYS A 9 21.487 4.541 -4.272 1.00 0.00 O ATOM 91 CB LYS A 9 24.172 5.442 -2.311 1.00 0.00 C ATOM 92 CG LYS A 9 24.011 5.425 -0.788 1.00 0.00 C ATOM 93 CD LYS A 9 25.045 6.302 -0.084 1.00 0.00 C ATOM 94 CE LYS A 9 24.945 6.057 1.424 1.00 0.00 C ATOM 95 NZ LYS A 9 26.243 6.238 2.098 1.00 0.00 N ATOM 0 H LYS A 9 23.409 4.459 -4.983 1.00 0.00 H new ATOM 0 HA LYS A 9 23.633 3.406 -2.268 1.00 0.00 H new ATOM 0 HB2 LYS A 9 25.231 5.425 -2.569 1.00 0.00 H new ATOM 0 HB3 LYS A 9 23.761 6.368 -2.714 1.00 0.00 H new ATOM 0 HG2 LYS A 9 23.010 5.768 -0.527 1.00 0.00 H new ATOM 0 HG3 LYS A 9 24.101 4.400 -0.427 1.00 0.00 H new ATOM 0 HD2 LYS A 9 26.048 6.066 -0.440 1.00 0.00 H new ATOM 0 HD3 LYS A 9 24.866 7.353 -0.309 1.00 0.00 H new ATOM 0 HE2 LYS A 9 24.214 6.741 1.855 1.00 0.00 H new ATOM 0 HE3 LYS A 9 24.580 5.046 1.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 26.132 6.063 3.117 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 26.935 5.568 1.705 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 26.579 7.211 1.948 1.00 0.00 H new ATOM 109 N GLY A 10 21.182 4.396 -2.069 1.00 0.00 N ATOM 110 CA GLY A 10 19.750 4.665 -2.083 1.00 0.00 C ATOM 111 C GLY A 10 19.239 5.002 -0.688 1.00 0.00 C ATOM 112 O GLY A 10 19.809 5.859 -0.008 1.00 0.00 O ATOM 0 H GLY A 10 21.538 4.166 -1.141 1.00 0.00 H new ATOM 0 HA2 GLY A 10 19.539 5.493 -2.760 1.00 0.00 H new ATOM 0 HA3 GLY A 10 19.218 3.795 -2.468 1.00 0.00 H new ATOM 116 N ALA A 11 18.140 4.364 -0.276 1.00 0.00 N ATOM 117 CA ALA A 11 17.397 4.684 0.944 1.00 0.00 C ATOM 118 C ALA A 11 16.855 3.404 1.610 1.00 0.00 C ATOM 119 O ALA A 11 17.394 2.315 1.402 1.00 0.00 O ATOM 120 CB ALA A 11 16.285 5.698 0.609 1.00 0.00 C ATOM 0 H ALA A 11 17.732 3.588 -0.798 1.00 0.00 H new ATOM 0 HA ALA A 11 18.063 5.145 1.673 1.00 0.00 H new ATOM 0 HB1 ALA A 11 15.728 5.940 1.514 1.00 0.00 H new ATOM 0 HB2 ALA A 11 16.731 6.606 0.204 1.00 0.00 H new ATOM 0 HB3 ALA A 11 15.608 5.266 -0.128 1.00 0.00 H new ATOM 126 N MET A 12 15.849 3.542 2.477 1.00 0.00 N ATOM 127 CA MET A 12 14.877 2.549 2.903 1.00 0.00 C ATOM 128 C MET A 12 13.514 3.216 2.888 1.00 0.00 C ATOM 129 O MET A 12 13.427 4.446 2.817 1.00 0.00 O ATOM 130 CB MET A 12 15.152 2.041 4.320 1.00 0.00 C ATOM 131 CG MET A 12 16.418 1.213 4.268 1.00 0.00 C ATOM 132 SD MET A 12 16.620 -0.083 5.511 1.00 0.00 S ATOM 133 CE MET A 12 15.284 -1.170 4.957 1.00 0.00 C ATOM 0 H MET A 12 15.685 4.437 2.937 1.00 0.00 H new ATOM 0 HA MET A 12 14.931 1.694 2.229 1.00 0.00 H new ATOM 0 HB2 MET A 12 15.268 2.876 5.011 1.00 0.00 H new ATOM 0 HB3 MET A 12 14.316 1.442 4.682 1.00 0.00 H new ATOM 0 HG2 MET A 12 16.475 0.747 3.284 1.00 0.00 H new ATOM 0 HG3 MET A 12 17.267 1.892 4.349 1.00 0.00 H new ATOM 0 HE1 MET A 12 14.497 -1.193 5.711 1.00 0.00 H new ATOM 0 HE2 MET A 12 14.876 -0.795 4.018 1.00 0.00 H new ATOM 0 HE3 MET A 12 15.673 -2.177 4.807 1.00 0.00 H new ATOM 143 N TYR A 13 12.490 2.382 2.990 1.00 0.00 N ATOM 144 CA TYR A 13 11.081 2.728 2.887 1.00 0.00 C ATOM 145 C TYR A 13 10.254 1.682 3.656 1.00 0.00 C ATOM 146 O TYR A 13 10.719 0.557 3.875 1.00 0.00 O ATOM 147 CB TYR A 13 10.713 2.773 1.393 1.00 0.00 C ATOM 148 CG TYR A 13 11.094 4.038 0.629 1.00 0.00 C ATOM 149 CD1 TYR A 13 10.753 5.310 1.136 1.00 0.00 C ATOM 150 CD2 TYR A 13 11.738 3.950 -0.623 1.00 0.00 C ATOM 151 CE1 TYR A 13 11.046 6.476 0.414 1.00 0.00 C ATOM 152 CE2 TYR A 13 12.062 5.119 -1.337 1.00 0.00 C ATOM 153 CZ TYR A 13 11.722 6.386 -0.817 1.00 0.00 C ATOM 154 OH TYR A 13 12.076 7.532 -1.455 1.00 0.00 O ATOM 0 H TYR A 13 12.630 1.385 3.157 1.00 0.00 H new ATOM 0 HA TYR A 13 10.870 3.703 3.326 1.00 0.00 H new ATOM 0 HB2 TYR A 13 11.186 1.923 0.901 1.00 0.00 H new ATOM 0 HB3 TYR A 13 9.636 2.634 1.304 1.00 0.00 H new ATOM 0 HD1 TYR A 13 10.259 5.387 2.094 1.00 0.00 H new ATOM 0 HD2 TYR A 13 11.983 2.982 -1.035 1.00 0.00 H new ATOM 0 HE1 TYR A 13 10.754 7.441 0.802 1.00 0.00 H new ATOM 0 HE2 TYR A 13 12.572 5.046 -2.286 1.00 0.00 H new ATOM 0 HH TYR A 13 12.536 7.312 -2.292 1.00 0.00 H new ATOM 164 N GLU A 14 9.052 2.064 4.092 1.00 0.00 N ATOM 165 CA GLU A 14 8.150 1.317 4.965 1.00 0.00 C ATOM 166 C GLU A 14 6.801 2.054 4.921 1.00 0.00 C ATOM 167 O GLU A 14 6.765 3.269 5.121 1.00 0.00 O ATOM 168 CB GLU A 14 8.778 1.248 6.375 1.00 0.00 C ATOM 169 CG GLU A 14 7.852 0.775 7.503 1.00 0.00 C ATOM 170 CD GLU A 14 8.654 0.503 8.784 1.00 0.00 C ATOM 171 OE1 GLU A 14 8.887 1.453 9.576 1.00 0.00 O ATOM 172 OE2 GLU A 14 9.066 -0.658 9.016 1.00 0.00 O ATOM 0 H GLU A 14 8.658 2.966 3.825 1.00 0.00 H new ATOM 0 HA GLU A 14 7.990 0.285 4.653 1.00 0.00 H new ATOM 0 HB2 GLU A 14 9.639 0.581 6.335 1.00 0.00 H new ATOM 0 HB3 GLU A 14 9.154 2.238 6.632 1.00 0.00 H new ATOM 0 HG2 GLU A 14 7.092 1.531 7.698 1.00 0.00 H new ATOM 0 HG3 GLU A 14 7.329 -0.131 7.196 1.00 0.00 H new ATOM 179 N VAL A 15 5.703 1.359 4.615 1.00 0.00 N ATOM 180 CA VAL A 15 4.378 1.928 4.347 1.00 0.00 C ATOM 181 C VAL A 15 3.304 1.108 5.045 1.00 0.00 C ATOM 182 O VAL A 15 3.519 -0.060 5.363 1.00 0.00 O ATOM 183 CB VAL A 15 4.150 2.013 2.813 1.00 0.00 C ATOM 184 CG1 VAL A 15 4.829 3.271 2.322 1.00 0.00 C ATOM 185 CG2 VAL A 15 4.231 0.686 2.045 1.00 0.00 C ATOM 0 H VAL A 15 5.712 0.342 4.544 1.00 0.00 H new ATOM 0 HA VAL A 15 4.320 2.940 4.748 1.00 0.00 H new ATOM 0 HB VAL A 15 3.101 2.153 2.550 1.00 0.00 H new ATOM 0 HG11 VAL A 15 4.689 3.363 1.245 1.00 0.00 H new ATOM 0 HG12 VAL A 15 4.394 4.137 2.820 1.00 0.00 H new ATOM 0 HG13 VAL A 15 5.894 3.221 2.546 1.00 0.00 H new ATOM 0 HG21 VAL A 15 4.056 0.868 0.985 1.00 0.00 H new ATOM 0 HG22 VAL A 15 5.220 0.248 2.179 1.00 0.00 H new ATOM 0 HG23 VAL A 15 3.475 -0.001 2.425 1.00 0.00 H new ATOM 195 N THR A 16 2.134 1.698 5.269 1.00 0.00 N ATOM 196 CA THR A 16 1.010 1.030 5.918 1.00 0.00 C ATOM 197 C THR A 16 -0.244 1.125 5.070 1.00 0.00 C ATOM 198 O THR A 16 -0.373 2.008 4.214 1.00 0.00 O ATOM 199 CB THR A 16 0.764 1.619 7.320 1.00 0.00 C ATOM 200 OG1 THR A 16 0.913 3.025 7.284 1.00 0.00 O ATOM 201 CG2 THR A 16 1.734 1.033 8.348 1.00 0.00 C ATOM 0 H THR A 16 1.937 2.663 5.003 1.00 0.00 H new ATOM 0 HA THR A 16 1.263 -0.025 6.027 1.00 0.00 H new ATOM 0 HB THR A 16 -0.252 1.360 7.618 1.00 0.00 H new ATOM 0 HG1 THR A 16 0.601 3.409 8.130 1.00 0.00 H new ATOM 0 HG21 THR A 16 1.534 1.469 9.327 1.00 0.00 H new ATOM 0 HG22 THR A 16 1.602 -0.048 8.398 1.00 0.00 H new ATOM 0 HG23 THR A 16 2.758 1.260 8.052 1.00 0.00 H new ATOM 209 N ILE A 17 -1.172 0.212 5.345 1.00 0.00 N ATOM 210 CA ILE A 17 -2.531 0.249 4.861 1.00 0.00 C ATOM 211 C ILE A 17 -3.425 -0.014 6.057 1.00 0.00 C ATOM 212 O ILE A 17 -3.384 -1.109 6.596 1.00 0.00 O ATOM 213 CB ILE A 17 -2.710 -0.750 3.696 1.00 0.00 C ATOM 214 CG1 ILE A 17 -4.151 -0.802 3.147 1.00 0.00 C ATOM 215 CG2 ILE A 17 -2.278 -2.195 3.995 1.00 0.00 C ATOM 216 CD1 ILE A 17 -4.726 0.561 2.758 1.00 0.00 C ATOM 0 H ILE A 17 -0.982 -0.599 5.933 1.00 0.00 H new ATOM 0 HA ILE A 17 -2.801 1.216 4.438 1.00 0.00 H new ATOM 0 HB ILE A 17 -2.032 -0.338 2.948 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -4.171 -1.454 2.274 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -4.798 -1.255 3.899 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -2.444 -2.814 3.114 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -1.220 -2.212 4.256 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -2.863 -2.585 4.828 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -5.741 0.434 2.382 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -4.741 1.212 3.632 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -4.106 1.010 1.982 1.00 0.00 H new ATOM 228 N GLU A 18 -4.183 0.975 6.517 1.00 0.00 N ATOM 229 CA GLU A 18 -5.317 0.744 7.400 1.00 0.00 C ATOM 230 C GLU A 18 -6.580 0.723 6.550 1.00 0.00 C ATOM 231 O GLU A 18 -6.684 1.492 5.591 1.00 0.00 O ATOM 232 CB GLU A 18 -5.447 1.872 8.422 1.00 0.00 C ATOM 233 CG GLU A 18 -4.302 1.948 9.438 1.00 0.00 C ATOM 234 CD GLU A 18 -4.661 2.990 10.495 1.00 0.00 C ATOM 235 OE1 GLU A 18 -5.631 2.722 11.252 1.00 0.00 O ATOM 236 OE2 GLU A 18 -4.041 4.081 10.522 1.00 0.00 O ATOM 0 H GLU A 18 -4.028 1.957 6.288 1.00 0.00 H new ATOM 0 HA GLU A 18 -5.172 -0.198 7.929 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -5.507 2.821 7.890 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -6.386 1.749 8.961 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -4.143 0.975 9.904 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -3.371 2.219 8.940 1.00 0.00 H new ATOM 243 N GLN A 19 -7.549 -0.106 6.934 1.00 0.00 N ATOM 244 CA GLN A 19 -8.849 -0.249 6.302 1.00 0.00 C ATOM 245 C GLN A 19 -9.911 -0.089 7.384 1.00 0.00 C ATOM 246 O GLN A 19 -9.807 -0.666 8.469 1.00 0.00 O ATOM 247 CB GLN A 19 -8.931 -1.596 5.560 1.00 0.00 C ATOM 248 CG GLN A 19 -8.039 -1.533 4.306 1.00 0.00 C ATOM 249 CD GLN A 19 -8.328 -2.637 3.298 1.00 0.00 C ATOM 250 OE1 GLN A 19 -8.975 -2.399 2.282 1.00 0.00 O ATOM 251 NE2 GLN A 19 -7.789 -3.820 3.515 1.00 0.00 N ATOM 0 H GLN A 19 -7.438 -0.726 7.736 1.00 0.00 H new ATOM 0 HA GLN A 19 -9.015 0.517 5.545 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -8.606 -2.406 6.213 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -9.962 -1.808 5.278 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -8.174 -0.566 3.822 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -6.994 -1.594 4.610 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -7.256 -3.989 4.368 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -7.904 -4.566 2.830 1.00 0.00 H new ATOM 260 N SER A 20 -10.878 0.789 7.138 1.00 0.00 N ATOM 261 CA SER A 20 -11.838 1.285 8.113 1.00 0.00 C ATOM 262 C SER A 20 -13.153 1.622 7.387 1.00 0.00 C ATOM 263 O SER A 20 -13.263 1.450 6.166 1.00 0.00 O ATOM 264 CB SER A 20 -11.231 2.503 8.830 1.00 0.00 C ATOM 265 OG SER A 20 -9.903 2.241 9.274 1.00 0.00 O ATOM 0 H SER A 20 -11.019 1.191 6.211 1.00 0.00 H new ATOM 0 HA SER A 20 -12.062 0.534 8.870 1.00 0.00 H new ATOM 0 HB2 SER A 20 -11.228 3.359 8.155 1.00 0.00 H new ATOM 0 HB3 SER A 20 -11.854 2.772 9.683 1.00 0.00 H new ATOM 0 HG SER A 20 -9.546 3.035 9.724 1.00 0.00 H new ATOM 271 N GLY A 21 -14.173 2.073 8.114 1.00 0.00 N ATOM 272 CA GLY A 21 -15.525 2.158 7.591 1.00 0.00 C ATOM 273 C GLY A 21 -16.048 0.757 7.279 1.00 0.00 C ATOM 274 O GLY A 21 -15.708 -0.212 7.965 1.00 0.00 O ATOM 0 H GLY A 21 -14.081 2.388 9.080 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -16.176 2.646 8.317 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -15.538 2.770 6.689 1.00 0.00 H new ATOM 278 N ASP A 22 -16.918 0.642 6.282 1.00 0.00 N ATOM 279 CA ASP A 22 -17.632 -0.582 5.927 1.00 0.00 C ATOM 280 C ASP A 22 -16.751 -1.535 5.102 1.00 0.00 C ATOM 281 O ASP A 22 -17.046 -1.854 3.951 1.00 0.00 O ATOM 282 CB ASP A 22 -18.900 -0.179 5.171 1.00 0.00 C ATOM 283 CG ASP A 22 -19.920 -1.305 5.134 1.00 0.00 C ATOM 284 OD1 ASP A 22 -20.694 -1.416 6.115 1.00 0.00 O ATOM 285 OD2 ASP A 22 -20.002 -2.051 4.138 1.00 0.00 O ATOM 0 H ASP A 22 -17.155 1.427 5.675 1.00 0.00 H new ATOM 0 HA ASP A 22 -17.899 -1.133 6.829 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -19.343 0.697 5.646 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -18.639 0.108 4.152 1.00 0.00 H new ATOM 290 N PHE A 23 -15.620 -1.981 5.659 1.00 0.00 N ATOM 291 CA PHE A 23 -14.637 -2.791 4.928 1.00 0.00 C ATOM 292 C PHE A 23 -15.040 -4.261 4.737 1.00 0.00 C ATOM 293 O PHE A 23 -14.188 -5.143 4.677 1.00 0.00 O ATOM 294 CB PHE A 23 -13.226 -2.584 5.518 1.00 0.00 C ATOM 295 CG PHE A 23 -12.974 -3.054 6.944 1.00 0.00 C ATOM 296 CD1 PHE A 23 -12.530 -4.366 7.195 1.00 0.00 C ATOM 297 CD2 PHE A 23 -13.082 -2.150 8.018 1.00 0.00 C ATOM 298 CE1 PHE A 23 -12.193 -4.770 8.498 1.00 0.00 C ATOM 299 CE2 PHE A 23 -12.751 -2.550 9.326 1.00 0.00 C ATOM 300 CZ PHE A 23 -12.300 -3.860 9.563 1.00 0.00 C ATOM 0 H PHE A 23 -15.360 -1.792 6.627 1.00 0.00 H new ATOM 0 HA PHE A 23 -14.613 -2.423 3.902 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -12.514 -3.092 4.868 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -12.997 -1.519 5.471 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -12.448 -5.068 6.379 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -13.422 -1.141 7.836 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -11.852 -5.778 8.680 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -12.843 -1.852 10.145 1.00 0.00 H new ATOM 0 HZ PHE A 23 -12.036 -4.167 10.564 1.00 0.00 H new ATOM 310 N ARG A 24 -16.338 -4.552 4.639 1.00 0.00 N ATOM 311 CA ARG A 24 -16.867 -5.903 4.802 1.00 0.00 C ATOM 312 C ARG A 24 -17.320 -6.562 3.509 1.00 0.00 C ATOM 313 O ARG A 24 -17.572 -7.767 3.518 1.00 0.00 O ATOM 314 CB ARG A 24 -17.979 -5.889 5.853 1.00 0.00 C ATOM 315 CG ARG A 24 -17.480 -5.426 7.228 1.00 0.00 C ATOM 316 CD ARG A 24 -18.683 -5.344 8.162 1.00 0.00 C ATOM 317 NE ARG A 24 -18.263 -5.233 9.564 1.00 0.00 N ATOM 318 CZ ARG A 24 -18.516 -4.227 10.407 1.00 0.00 C ATOM 319 NH1 ARG A 24 -19.226 -3.166 10.046 1.00 0.00 N ATOM 320 NH2 ARG A 24 -18.057 -4.299 11.647 1.00 0.00 N ATOM 0 H ARG A 24 -17.054 -3.852 4.443 1.00 0.00 H new ATOM 0 HA ARG A 24 -16.042 -6.527 5.145 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -18.781 -5.230 5.520 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -18.404 -6.889 5.942 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -16.740 -6.124 7.620 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -16.992 -4.455 7.149 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -19.296 -4.483 7.894 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -19.305 -6.230 8.036 1.00 0.00 H new ATOM 0 HE ARG A 24 -17.717 -6.010 9.937 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -19.598 -3.100 9.099 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -19.400 -2.417 10.716 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -17.520 -5.113 11.945 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -18.241 -3.540 12.304 1.00 0.00 H new ATOM 334 N SER A 25 -17.399 -5.824 2.407 1.00 0.00 N ATOM 335 CA SER A 25 -17.742 -6.363 1.109 1.00 0.00 C ATOM 336 C SER A 25 -17.104 -5.422 0.095 1.00 0.00 C ATOM 337 O SER A 25 -17.732 -4.467 -0.358 1.00 0.00 O ATOM 338 CB SER A 25 -19.272 -6.492 1.002 1.00 0.00 C ATOM 339 OG SER A 25 -19.650 -7.481 0.063 1.00 0.00 O ATOM 0 H SER A 25 -17.223 -4.819 2.397 1.00 0.00 H new ATOM 0 HA SER A 25 -17.366 -7.370 0.929 1.00 0.00 H new ATOM 0 HB2 SER A 25 -19.685 -6.741 1.979 1.00 0.00 H new ATOM 0 HB3 SER A 25 -19.699 -5.532 0.711 1.00 0.00 H new ATOM 0 HG SER A 25 -20.628 -7.537 0.022 1.00 0.00 H new ATOM 345 N PHE A 26 -15.816 -5.646 -0.177 1.00 0.00 N ATOM 346 CA PHE A 26 -15.074 -4.962 -1.232 1.00 0.00 C ATOM 347 C PHE A 26 -14.035 -5.901 -1.854 1.00 0.00 C ATOM 348 O PHE A 26 -13.726 -6.942 -1.270 1.00 0.00 O ATOM 349 CB PHE A 26 -14.404 -3.704 -0.665 1.00 0.00 C ATOM 350 CG PHE A 26 -15.277 -2.468 -0.705 1.00 0.00 C ATOM 351 CD1 PHE A 26 -15.547 -1.860 -1.944 1.00 0.00 C ATOM 352 CD2 PHE A 26 -15.789 -1.902 0.478 1.00 0.00 C ATOM 353 CE1 PHE A 26 -16.220 -0.630 -1.992 1.00 0.00 C ATOM 354 CE2 PHE A 26 -16.528 -0.706 0.422 1.00 0.00 C ATOM 355 CZ PHE A 26 -16.724 -0.057 -0.810 1.00 0.00 C ATOM 0 H PHE A 26 -15.252 -6.320 0.341 1.00 0.00 H new ATOM 0 HA PHE A 26 -15.768 -4.663 -2.017 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -14.111 -3.895 0.367 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -13.490 -3.508 -1.225 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -15.236 -2.341 -2.860 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -15.615 -2.386 1.428 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -16.351 -0.123 -2.936 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -16.945 -0.286 1.326 1.00 0.00 H new ATOM 0 HZ PHE A 26 -17.260 0.880 -0.849 1.00 0.00 H new ATOM 365 N ILE A 27 -13.478 -5.527 -3.016 1.00 0.00 N ATOM 366 CA ILE A 27 -12.385 -6.223 -3.697 1.00 0.00 C ATOM 367 C ILE A 27 -11.340 -5.178 -4.091 1.00 0.00 C ATOM 368 O ILE A 27 -11.396 -4.599 -5.180 1.00 0.00 O ATOM 369 CB ILE A 27 -12.902 -6.981 -4.937 1.00 0.00 C ATOM 370 CG1 ILE A 27 -14.026 -7.965 -4.532 1.00 0.00 C ATOM 371 CG2 ILE A 27 -11.744 -7.744 -5.623 1.00 0.00 C ATOM 372 CD1 ILE A 27 -14.468 -8.913 -5.646 1.00 0.00 C ATOM 0 H ILE A 27 -13.791 -4.699 -3.523 1.00 0.00 H new ATOM 0 HA ILE A 27 -11.942 -6.965 -3.034 1.00 0.00 H new ATOM 0 HB ILE A 27 -13.308 -6.257 -5.644 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -13.685 -8.557 -3.682 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -14.890 -7.392 -4.195 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -12.124 -8.274 -6.496 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -10.976 -7.036 -5.934 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -11.315 -8.460 -4.922 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -15.258 -9.567 -5.276 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -14.843 -8.333 -6.490 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -13.619 -9.516 -5.968 1.00 0.00 H new ATOM 384 N LYS A 28 -10.390 -4.887 -3.206 1.00 0.00 N ATOM 385 CA LYS A 28 -9.301 -3.962 -3.523 1.00 0.00 C ATOM 386 C LYS A 28 -8.167 -4.671 -4.267 1.00 0.00 C ATOM 387 O LYS A 28 -8.087 -5.904 -4.270 1.00 0.00 O ATOM 388 CB LYS A 28 -8.810 -3.294 -2.233 1.00 0.00 C ATOM 389 CG LYS A 28 -8.296 -4.290 -1.187 1.00 0.00 C ATOM 390 CD LYS A 28 -6.899 -3.946 -0.678 1.00 0.00 C ATOM 391 CE LYS A 28 -6.893 -2.653 0.137 1.00 0.00 C ATOM 392 NZ LYS A 28 -6.060 -1.608 -0.490 1.00 0.00 N ATOM 0 H LYS A 28 -10.351 -5.277 -2.264 1.00 0.00 H new ATOM 0 HA LYS A 28 -9.673 -3.188 -4.194 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -8.013 -2.592 -2.477 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -9.625 -2.713 -1.801 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -8.988 -4.315 -0.345 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -8.284 -5.290 -1.620 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -6.525 -4.765 -0.063 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -6.219 -3.845 -1.524 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -7.914 -2.287 0.244 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -6.522 -2.859 1.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -5.233 -1.417 0.110 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -5.741 -1.933 -1.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -6.618 -0.737 -0.598 1.00 0.00 H new ATOM 406 N SER A 29 -7.241 -3.890 -4.819 1.00 0.00 N ATOM 407 CA SER A 29 -5.916 -4.346 -5.216 1.00 0.00 C ATOM 408 C SER A 29 -4.879 -3.462 -4.524 1.00 0.00 C ATOM 409 O SER A 29 -5.185 -2.334 -4.104 1.00 0.00 O ATOM 410 CB SER A 29 -5.781 -4.324 -6.749 1.00 0.00 C ATOM 411 OG SER A 29 -4.599 -5.002 -7.158 1.00 0.00 O ATOM 0 H SER A 29 -7.397 -2.900 -5.006 1.00 0.00 H new ATOM 0 HA SER A 29 -5.752 -5.379 -4.907 1.00 0.00 H new ATOM 0 HB2 SER A 29 -6.653 -4.796 -7.203 1.00 0.00 H new ATOM 0 HB3 SER A 29 -5.756 -3.293 -7.102 1.00 0.00 H new ATOM 0 HG SER A 29 -4.531 -4.980 -8.135 1.00 0.00 H new ATOM 417 N VAL A 30 -3.639 -3.951 -4.446 1.00 0.00 N ATOM 418 CA VAL A 30 -2.455 -3.143 -4.202 1.00 0.00 C ATOM 419 C VAL A 30 -1.332 -3.689 -5.086 1.00 0.00 C ATOM 420 O VAL A 30 -0.868 -4.816 -4.902 1.00 0.00 O ATOM 421 CB VAL A 30 -2.051 -3.105 -2.714 1.00 0.00 C ATOM 422 CG1 VAL A 30 -0.924 -2.080 -2.523 1.00 0.00 C ATOM 423 CG2 VAL A 30 -3.193 -2.652 -1.794 1.00 0.00 C ATOM 0 H VAL A 30 -3.432 -4.944 -4.554 1.00 0.00 H new ATOM 0 HA VAL A 30 -2.667 -2.105 -4.458 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.756 -4.121 -2.453 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -0.634 -2.049 -1.473 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -0.064 -2.368 -3.128 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -1.272 -1.095 -2.833 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -2.847 -2.646 -0.760 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.511 -1.648 -2.076 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -4.033 -3.340 -1.891 1.00 0.00 H new ATOM 433 N VAL A 31 -0.899 -2.884 -6.050 1.00 0.00 N ATOM 434 CA VAL A 31 0.384 -2.989 -6.728 1.00 0.00 C ATOM 435 C VAL A 31 1.439 -2.472 -5.741 1.00 0.00 C ATOM 436 O VAL A 31 1.264 -1.378 -5.192 1.00 0.00 O ATOM 437 CB VAL A 31 0.365 -2.087 -7.985 1.00 0.00 C ATOM 438 CG1 VAL A 31 1.637 -2.282 -8.824 1.00 0.00 C ATOM 439 CG2 VAL A 31 -0.880 -2.289 -8.866 1.00 0.00 C ATOM 0 H VAL A 31 -1.460 -2.105 -6.395 1.00 0.00 H new ATOM 0 HA VAL A 31 0.597 -4.013 -7.034 1.00 0.00 H new ATOM 0 HB VAL A 31 0.327 -1.063 -7.612 1.00 0.00 H new ATOM 0 HG11 VAL A 31 1.597 -1.636 -9.701 1.00 0.00 H new ATOM 0 HG12 VAL A 31 2.511 -2.026 -8.225 1.00 0.00 H new ATOM 0 HG13 VAL A 31 1.707 -3.322 -9.142 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -0.827 -1.625 -9.729 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -0.921 -3.324 -9.206 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -1.776 -2.062 -8.288 1.00 0.00 H new ATOM 449 N VAL A 32 2.537 -3.201 -5.533 1.00 0.00 N ATOM 450 CA VAL A 32 3.661 -2.786 -4.696 1.00 0.00 C ATOM 451 C VAL A 32 4.947 -2.964 -5.502 1.00 0.00 C ATOM 452 O VAL A 32 5.082 -3.921 -6.265 1.00 0.00 O ATOM 453 CB VAL A 32 3.668 -3.600 -3.381 1.00 0.00 C ATOM 454 CG1 VAL A 32 4.845 -3.211 -2.475 1.00 0.00 C ATOM 455 CG2 VAL A 32 2.362 -3.381 -2.602 1.00 0.00 C ATOM 0 H VAL A 32 2.671 -4.120 -5.954 1.00 0.00 H new ATOM 0 HA VAL A 32 3.574 -1.737 -4.413 1.00 0.00 H new ATOM 0 HB VAL A 32 3.768 -4.648 -3.662 1.00 0.00 H new ATOM 0 HG11 VAL A 32 4.813 -3.806 -1.562 1.00 0.00 H new ATOM 0 HG12 VAL A 32 5.783 -3.398 -2.997 1.00 0.00 H new ATOM 0 HG13 VAL A 32 4.775 -2.153 -2.222 1.00 0.00 H new ATOM 0 HG21 VAL A 32 2.386 -3.962 -1.680 1.00 0.00 H new ATOM 0 HG22 VAL A 32 2.255 -2.323 -2.361 1.00 0.00 H new ATOM 0 HG23 VAL A 32 1.517 -3.702 -3.211 1.00 0.00 H new ATOM 465 N VAL A 33 5.910 -2.056 -5.331 1.00 0.00 N ATOM 466 CA VAL A 33 7.211 -2.063 -5.995 1.00 0.00 C ATOM 467 C VAL A 33 8.250 -1.677 -4.937 1.00 0.00 C ATOM 468 O VAL A 33 7.933 -0.883 -4.049 1.00 0.00 O ATOM 469 CB VAL A 33 7.202 -1.075 -7.188 1.00 0.00 C ATOM 470 CG1 VAL A 33 8.485 -1.178 -8.031 1.00 0.00 C ATOM 471 CG2 VAL A 33 5.997 -1.288 -8.125 1.00 0.00 C ATOM 0 H VAL A 33 5.798 -1.263 -4.699 1.00 0.00 H new ATOM 0 HA VAL A 33 7.450 -3.044 -6.406 1.00 0.00 H new ATOM 0 HB VAL A 33 7.134 -0.086 -6.735 1.00 0.00 H new ATOM 0 HG11 VAL A 33 8.436 -0.468 -8.856 1.00 0.00 H new ATOM 0 HG12 VAL A 33 9.349 -0.950 -7.407 1.00 0.00 H new ATOM 0 HG13 VAL A 33 8.580 -2.189 -8.427 1.00 0.00 H new ATOM 0 HG21 VAL A 33 6.041 -0.569 -8.943 1.00 0.00 H new ATOM 0 HG22 VAL A 33 6.025 -2.300 -8.529 1.00 0.00 H new ATOM 0 HG23 VAL A 33 5.072 -1.146 -7.566 1.00 0.00 H new ATOM 481 N ALA A 34 9.467 -2.225 -5.038 1.00 0.00 N ATOM 482 CA ALA A 34 10.634 -1.814 -4.271 1.00 0.00 C ATOM 483 C ALA A 34 11.857 -1.895 -5.186 1.00 0.00 C ATOM 484 O ALA A 34 12.158 -2.973 -5.703 1.00 0.00 O ATOM 485 CB ALA A 34 10.825 -2.686 -3.027 1.00 0.00 C ATOM 0 H ALA A 34 9.666 -2.992 -5.680 1.00 0.00 H new ATOM 0 HA ALA A 34 10.495 -0.792 -3.918 1.00 0.00 H new ATOM 0 HB1 ALA A 34 11.705 -2.350 -2.479 1.00 0.00 H new ATOM 0 HB2 ALA A 34 9.946 -2.604 -2.387 1.00 0.00 H new ATOM 0 HB3 ALA A 34 10.959 -3.725 -3.328 1.00 0.00 H new ATOM 491 N ASN A 35 12.541 -0.773 -5.410 1.00 0.00 N ATOM 492 CA ASN A 35 13.807 -0.721 -6.154 1.00 0.00 C ATOM 493 C ASN A 35 14.945 -1.220 -5.274 1.00 0.00 C ATOM 494 O ASN A 35 15.127 -0.667 -4.193 1.00 0.00 O ATOM 495 CB ASN A 35 14.108 0.730 -6.543 1.00 0.00 C ATOM 496 CG ASN A 35 15.376 0.938 -7.377 1.00 0.00 C ATOM 497 OD1 ASN A 35 16.486 0.551 -7.008 1.00 0.00 O ATOM 498 ND2 ASN A 35 15.245 1.655 -8.477 1.00 0.00 N ATOM 0 H ASN A 35 12.230 0.140 -5.077 1.00 0.00 H new ATOM 0 HA ASN A 35 13.719 -1.346 -7.043 1.00 0.00 H new ATOM 0 HB2 ASN A 35 13.258 1.122 -7.101 1.00 0.00 H new ATOM 0 HB3 ASN A 35 14.192 1.323 -5.632 1.00 0.00 H new ATOM 0 HD21 ASN A 35 16.067 1.894 -9.031 1.00 0.00 H new ATOM 0 HD22 ASN A 35 14.321 1.970 -8.773 1.00 0.00 H new ATOM 505 N GLY A 36 15.728 -2.183 -5.753 1.00 0.00 N ATOM 506 CA GLY A 36 17.043 -2.538 -5.223 1.00 0.00 C ATOM 507 C GLY A 36 17.037 -3.653 -4.176 1.00 0.00 C ATOM 508 O GLY A 36 18.107 -3.996 -3.655 1.00 0.00 O ATOM 0 H GLY A 36 15.455 -2.759 -6.550 1.00 0.00 H new ATOM 0 HA2 GLY A 36 17.683 -2.842 -6.052 1.00 0.00 H new ATOM 0 HA3 GLY A 36 17.493 -1.648 -4.782 1.00 0.00 H new ATOM 512 N THR A 37 15.868 -4.204 -3.834 1.00 0.00 N ATOM 513 CA THR A 37 15.701 -5.118 -2.715 1.00 0.00 C ATOM 514 C THR A 37 14.397 -5.914 -2.856 1.00 0.00 C ATOM 515 O THR A 37 13.658 -5.766 -3.832 1.00 0.00 O ATOM 516 CB THR A 37 15.801 -4.309 -1.409 1.00 0.00 C ATOM 517 OG1 THR A 37 15.949 -5.165 -0.292 1.00 0.00 O ATOM 518 CG2 THR A 37 14.617 -3.364 -1.233 1.00 0.00 C ATOM 0 H THR A 37 15.001 -4.020 -4.339 1.00 0.00 H new ATOM 0 HA THR A 37 16.492 -5.868 -2.700 1.00 0.00 H new ATOM 0 HB THR A 37 16.695 -3.689 -1.478 1.00 0.00 H new ATOM 0 HG1 THR A 37 15.202 -5.027 0.327 1.00 0.00 H new ATOM 0 HG21 THR A 37 14.727 -2.813 -0.299 1.00 0.00 H new ATOM 0 HG22 THR A 37 14.584 -2.663 -2.067 1.00 0.00 H new ATOM 0 HG23 THR A 37 13.692 -3.940 -1.207 1.00 0.00 H new ATOM 526 N GLN A 38 14.123 -6.782 -1.881 1.00 0.00 N ATOM 527 CA GLN A 38 12.861 -7.473 -1.712 1.00 0.00 C ATOM 528 C GLN A 38 12.076 -6.839 -0.561 1.00 0.00 C ATOM 529 O GLN A 38 12.577 -5.974 0.170 1.00 0.00 O ATOM 530 CB GLN A 38 13.129 -8.976 -1.514 1.00 0.00 C ATOM 531 CG GLN A 38 13.401 -9.672 -2.856 1.00 0.00 C ATOM 532 CD GLN A 38 14.835 -9.554 -3.370 1.00 0.00 C ATOM 533 OE1 GLN A 38 15.707 -10.357 -3.048 1.00 0.00 O ATOM 534 NE2 GLN A 38 15.091 -8.572 -4.218 1.00 0.00 N ATOM 0 H GLN A 38 14.806 -7.027 -1.164 1.00 0.00 H new ATOM 0 HA GLN A 38 12.240 -7.374 -2.603 1.00 0.00 H new ATOM 0 HB2 GLN A 38 13.983 -9.112 -0.851 1.00 0.00 H new ATOM 0 HB3 GLN A 38 12.271 -9.440 -1.028 1.00 0.00 H new ATOM 0 HG2 GLN A 38 13.154 -10.729 -2.756 1.00 0.00 H new ATOM 0 HG3 GLN A 38 12.728 -9.257 -3.606 1.00 0.00 H new ATOM 0 HE21 GLN A 38 14.355 -7.914 -4.474 1.00 0.00 H new ATOM 0 HE22 GLN A 38 16.025 -8.472 -4.616 1.00 0.00 H new ATOM 543 N LEU A 39 10.819 -7.255 -0.453 1.00 0.00 N ATOM 544 CA LEU A 39 9.806 -6.756 0.450 1.00 0.00 C ATOM 545 C LEU A 39 9.656 -7.722 1.624 1.00 0.00 C ATOM 546 O LEU A 39 10.067 -8.884 1.552 1.00 0.00 O ATOM 547 CB LEU A 39 8.487 -6.663 -0.337 1.00 0.00 C ATOM 548 CG LEU A 39 7.483 -5.645 0.224 1.00 0.00 C ATOM 549 CD1 LEU A 39 7.903 -4.212 -0.136 1.00 0.00 C ATOM 550 CD2 LEU A 39 6.100 -5.944 -0.348 1.00 0.00 C ATOM 0 H LEU A 39 10.462 -8.007 -1.042 1.00 0.00 H new ATOM 0 HA LEU A 39 10.078 -5.776 0.843 1.00 0.00 H new ATOM 0 HB2 LEU A 39 8.713 -6.401 -1.371 1.00 0.00 H new ATOM 0 HB3 LEU A 39 8.018 -7.647 -0.353 1.00 0.00 H new ATOM 0 HG LEU A 39 7.460 -5.728 1.311 1.00 0.00 H new ATOM 0 HD11 LEU A 39 7.178 -3.507 0.271 1.00 0.00 H new ATOM 0 HD12 LEU A 39 8.887 -4.005 0.285 1.00 0.00 H new ATOM 0 HD13 LEU A 39 7.943 -4.106 -1.220 1.00 0.00 H new ATOM 0 HD21 LEU A 39 5.381 -5.226 0.045 1.00 0.00 H new ATOM 0 HD22 LEU A 39 6.132 -5.868 -1.435 1.00 0.00 H new ATOM 0 HD23 LEU A 39 5.799 -6.952 -0.063 1.00 0.00 H new ATOM 562 N LYS A 40 9.009 -7.250 2.682 1.00 0.00 N ATOM 563 CA LYS A 40 8.645 -8.001 3.866 1.00 0.00 C ATOM 564 C LYS A 40 7.180 -7.733 4.114 1.00 0.00 C ATOM 565 O LYS A 40 6.795 -6.591 4.387 1.00 0.00 O ATOM 566 CB LYS A 40 9.520 -7.584 5.049 1.00 0.00 C ATOM 567 CG LYS A 40 9.260 -8.475 6.270 1.00 0.00 C ATOM 568 CD LYS A 40 10.183 -8.118 7.440 1.00 0.00 C ATOM 569 CE LYS A 40 10.093 -9.231 8.485 1.00 0.00 C ATOM 570 NZ LYS A 40 10.970 -8.995 9.648 1.00 0.00 N ATOM 0 H LYS A 40 8.709 -6.276 2.735 1.00 0.00 H new ATOM 0 HA LYS A 40 8.807 -9.071 3.733 1.00 0.00 H new ATOM 0 HB2 LYS A 40 10.571 -7.646 4.767 1.00 0.00 H new ATOM 0 HB3 LYS A 40 9.319 -6.544 5.305 1.00 0.00 H new ATOM 0 HG2 LYS A 40 8.221 -8.371 6.582 1.00 0.00 H new ATOM 0 HG3 LYS A 40 9.407 -9.520 5.996 1.00 0.00 H new ATOM 0 HD2 LYS A 40 11.210 -8.007 7.092 1.00 0.00 H new ATOM 0 HD3 LYS A 40 9.889 -7.163 7.877 1.00 0.00 H new ATOM 0 HE2 LYS A 40 9.062 -9.321 8.826 1.00 0.00 H new ATOM 0 HE3 LYS A 40 10.359 -10.181 8.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 10.869 -9.779 10.324 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 11.959 -8.936 9.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 10.701 -8.103 10.110 1.00 0.00 H new ATOM 584 N ASP A 41 6.369 -8.769 3.982 1.00 0.00 N ATOM 585 CA ASP A 41 4.953 -8.698 4.300 1.00 0.00 C ATOM 586 C ASP A 41 4.818 -8.563 5.812 1.00 0.00 C ATOM 587 O ASP A 41 5.282 -9.432 6.555 1.00 0.00 O ATOM 588 CB ASP A 41 4.175 -9.917 3.801 1.00 0.00 C ATOM 589 CG ASP A 41 2.693 -9.552 3.743 1.00 0.00 C ATOM 590 OD1 ASP A 41 2.182 -9.042 4.762 1.00 0.00 O ATOM 591 OD2 ASP A 41 2.099 -9.705 2.652 1.00 0.00 O ATOM 0 H ASP A 41 6.674 -9.684 3.651 1.00 0.00 H new ATOM 0 HA ASP A 41 4.523 -7.836 3.791 1.00 0.00 H new ATOM 0 HB2 ASP A 41 4.531 -10.216 2.815 1.00 0.00 H new ATOM 0 HB3 ASP A 41 4.331 -10.765 4.467 1.00 0.00 H new ATOM 596 N GLY A 42 4.231 -7.470 6.295 1.00 0.00 N ATOM 597 CA GLY A 42 4.028 -7.251 7.716 1.00 0.00 C ATOM 598 C GLY A 42 2.998 -8.195 8.338 1.00 0.00 C ATOM 599 O GLY A 42 2.844 -8.149 9.559 1.00 0.00 O ATOM 0 H GLY A 42 3.884 -6.713 5.707 1.00 0.00 H new ATOM 0 HA2 GLY A 42 4.979 -7.372 8.234 1.00 0.00 H new ATOM 0 HA3 GLY A 42 3.708 -6.221 7.875 1.00 0.00 H new ATOM 603 N ALA A 43 2.275 -9.013 7.569 1.00 0.00 N ATOM 604 CA ALA A 43 1.324 -9.990 8.079 1.00 0.00 C ATOM 605 C ALA A 43 2.041 -11.006 8.965 1.00 0.00 C ATOM 606 O ALA A 43 1.735 -11.118 10.158 1.00 0.00 O ATOM 607 CB ALA A 43 0.633 -10.692 6.904 1.00 0.00 C ATOM 0 H ALA A 43 2.340 -9.010 6.551 1.00 0.00 H new ATOM 0 HA ALA A 43 0.570 -9.483 8.681 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -0.079 -11.424 7.285 1.00 0.00 H new ATOM 0 HB2 ALA A 43 0.106 -9.954 6.298 1.00 0.00 H new ATOM 0 HB3 ALA A 43 1.380 -11.198 6.292 1.00 0.00 H new ATOM 613 N THR A 44 3.005 -11.710 8.369 1.00 0.00 N ATOM 614 CA THR A 44 3.662 -12.899 8.902 1.00 0.00 C ATOM 615 C THR A 44 5.191 -12.808 8.761 1.00 0.00 C ATOM 616 O THR A 44 5.914 -13.736 9.138 1.00 0.00 O ATOM 617 CB THR A 44 3.060 -14.167 8.238 1.00 0.00 C ATOM 618 OG1 THR A 44 2.443 -13.922 6.981 1.00 0.00 O ATOM 619 CG2 THR A 44 1.989 -14.764 9.155 1.00 0.00 C ATOM 0 H THR A 44 3.366 -11.449 7.451 1.00 0.00 H new ATOM 0 HA THR A 44 3.473 -12.968 9.973 1.00 0.00 H new ATOM 0 HB THR A 44 3.901 -14.842 8.078 1.00 0.00 H new ATOM 0 HG1 THR A 44 2.089 -14.762 6.621 1.00 0.00 H new ATOM 0 HG21 THR A 44 1.566 -15.654 8.689 1.00 0.00 H new ATOM 0 HG22 THR A 44 2.438 -15.033 10.111 1.00 0.00 H new ATOM 0 HG23 THR A 44 1.200 -14.030 9.318 1.00 0.00 H new ATOM 627 N GLY A 45 5.700 -11.681 8.255 1.00 0.00 N ATOM 628 CA GLY A 45 7.118 -11.414 8.084 1.00 0.00 C ATOM 629 C GLY A 45 7.668 -12.027 6.800 1.00 0.00 C ATOM 630 O GLY A 45 8.877 -12.217 6.688 1.00 0.00 O ATOM 0 H GLY A 45 5.111 -10.908 7.945 1.00 0.00 H new ATOM 0 HA2 GLY A 45 7.284 -10.337 8.071 1.00 0.00 H new ATOM 0 HA3 GLY A 45 7.667 -11.811 8.938 1.00 0.00 H new ATOM 634 N GLU A 46 6.798 -12.381 5.858 1.00 0.00 N ATOM 635 CA GLU A 46 7.122 -13.163 4.675 1.00 0.00 C ATOM 636 C GLU A 46 7.981 -12.333 3.724 1.00 0.00 C ATOM 637 O GLU A 46 7.615 -11.219 3.355 1.00 0.00 O ATOM 638 CB GLU A 46 5.816 -13.615 4.007 1.00 0.00 C ATOM 639 CG GLU A 46 5.074 -14.628 4.893 1.00 0.00 C ATOM 640 CD GLU A 46 5.764 -15.989 4.864 1.00 0.00 C ATOM 641 OE1 GLU A 46 5.713 -16.667 3.813 1.00 0.00 O ATOM 642 OE2 GLU A 46 6.346 -16.386 5.899 1.00 0.00 O ATOM 0 H GLU A 46 5.813 -12.120 5.902 1.00 0.00 H new ATOM 0 HA GLU A 46 7.696 -14.048 4.950 1.00 0.00 H new ATOM 0 HB2 GLU A 46 5.178 -12.751 3.822 1.00 0.00 H new ATOM 0 HB3 GLU A 46 6.034 -14.063 3.038 1.00 0.00 H new ATOM 0 HG2 GLU A 46 5.033 -14.259 5.918 1.00 0.00 H new ATOM 0 HG3 GLU A 46 4.044 -14.731 4.550 1.00 0.00 H new ATOM 649 N SER A 47 9.146 -12.854 3.353 1.00 0.00 N ATOM 650 CA SER A 47 10.029 -12.265 2.359 1.00 0.00 C ATOM 651 C SER A 47 9.461 -12.492 0.957 1.00 0.00 C ATOM 652 O SER A 47 9.402 -13.634 0.484 1.00 0.00 O ATOM 653 CB SER A 47 11.449 -12.831 2.517 1.00 0.00 C ATOM 654 OG SER A 47 11.490 -14.026 3.282 1.00 0.00 O ATOM 0 H SER A 47 9.510 -13.721 3.748 1.00 0.00 H new ATOM 0 HA SER A 47 10.093 -11.188 2.511 1.00 0.00 H new ATOM 0 HB2 SER A 47 11.869 -13.024 1.530 1.00 0.00 H new ATOM 0 HB3 SER A 47 12.082 -12.081 2.991 1.00 0.00 H new ATOM 0 HG SER A 47 12.416 -14.341 3.348 1.00 0.00 H new ATOM 660 N LEU A 48 9.029 -11.420 0.295 1.00 0.00 N ATOM 661 CA LEU A 48 8.414 -11.481 -1.026 1.00 0.00 C ATOM 662 C LEU A 48 9.213 -10.635 -1.993 1.00 0.00 C ATOM 663 O LEU A 48 9.694 -9.555 -1.650 1.00 0.00 O ATOM 664 CB LEU A 48 6.971 -10.969 -0.981 1.00 0.00 C ATOM 665 CG LEU A 48 6.071 -11.645 0.067 1.00 0.00 C ATOM 666 CD1 LEU A 48 4.714 -10.964 -0.004 1.00 0.00 C ATOM 667 CD2 LEU A 48 5.939 -13.152 -0.132 1.00 0.00 C ATOM 0 H LEU A 48 9.098 -10.473 0.668 1.00 0.00 H new ATOM 0 HA LEU A 48 8.405 -12.520 -1.355 1.00 0.00 H new ATOM 0 HB2 LEU A 48 6.988 -9.897 -0.785 1.00 0.00 H new ATOM 0 HB3 LEU A 48 6.522 -11.106 -1.965 1.00 0.00 H new ATOM 0 HG LEU A 48 6.523 -11.530 1.052 1.00 0.00 H new ATOM 0 HD11 LEU A 48 4.042 -11.415 0.726 1.00 0.00 H new ATOM 0 HD12 LEU A 48 4.828 -9.902 0.215 1.00 0.00 H new ATOM 0 HD13 LEU A 48 4.298 -11.086 -1.004 1.00 0.00 H new ATOM 0 HD21 LEU A 48 5.291 -13.566 0.641 1.00 0.00 H new ATOM 0 HD22 LEU A 48 5.508 -13.353 -1.113 1.00 0.00 H new ATOM 0 HD23 LEU A 48 6.923 -13.615 -0.066 1.00 0.00 H new ATOM 679 N ALA A 49 9.328 -11.108 -3.225 1.00 0.00 N ATOM 680 CA ALA A 49 9.979 -10.383 -4.287 1.00 0.00 C ATOM 681 C ALA A 49 8.952 -9.486 -4.963 1.00 0.00 C ATOM 682 O ALA A 49 8.215 -9.888 -5.862 1.00 0.00 O ATOM 683 CB ALA A 49 10.672 -11.356 -5.228 1.00 0.00 C ATOM 0 H ALA A 49 8.965 -12.017 -3.511 1.00 0.00 H new ATOM 0 HA ALA A 49 10.766 -9.733 -3.904 1.00 0.00 H new ATOM 0 HB1 ALA A 49 11.162 -10.802 -6.028 1.00 0.00 H new ATOM 0 HB2 ALA A 49 11.416 -11.929 -4.675 1.00 0.00 H new ATOM 0 HB3 ALA A 49 9.935 -12.036 -5.656 1.00 0.00 H new ATOM 689 N SER A 50 8.919 -8.241 -4.511 1.00 0.00 N ATOM 690 CA SER A 50 8.407 -7.111 -5.263 1.00 0.00 C ATOM 691 C SER A 50 9.058 -7.063 -6.663 1.00 0.00 C ATOM 692 O SER A 50 10.210 -7.489 -6.779 1.00 0.00 O ATOM 693 CB SER A 50 8.747 -5.861 -4.440 1.00 0.00 C ATOM 694 OG SER A 50 10.013 -5.974 -3.795 1.00 0.00 O ATOM 0 H SER A 50 9.258 -7.985 -3.584 1.00 0.00 H new ATOM 0 HA SER A 50 7.331 -7.183 -5.423 1.00 0.00 H new ATOM 0 HB2 SER A 50 8.749 -4.987 -5.092 1.00 0.00 H new ATOM 0 HB3 SER A 50 7.972 -5.698 -3.691 1.00 0.00 H new ATOM 0 HG SER A 50 10.713 -5.627 -4.386 1.00 0.00 H new ATOM 700 N PRO A 51 8.427 -6.472 -7.696 1.00 0.00 N ATOM 701 CA PRO A 51 7.098 -5.875 -7.684 1.00 0.00 C ATOM 702 C PRO A 51 6.009 -6.951 -7.651 1.00 0.00 C ATOM 703 O PRO A 51 6.018 -7.896 -8.440 1.00 0.00 O ATOM 704 CB PRO A 51 7.021 -5.031 -8.959 1.00 0.00 C ATOM 705 CG PRO A 51 7.944 -5.760 -9.930 1.00 0.00 C ATOM 706 CD PRO A 51 9.031 -6.329 -9.016 1.00 0.00 C ATOM 0 HA PRO A 51 6.934 -5.266 -6.795 1.00 0.00 H new ATOM 0 HB2 PRO A 51 6.002 -4.974 -9.341 1.00 0.00 H new ATOM 0 HB3 PRO A 51 7.353 -4.008 -8.783 1.00 0.00 H new ATOM 0 HG2 PRO A 51 7.419 -6.548 -10.471 1.00 0.00 H new ATOM 0 HG3 PRO A 51 8.359 -5.083 -10.677 1.00 0.00 H new ATOM 0 HD2 PRO A 51 9.386 -7.291 -9.387 1.00 0.00 H new ATOM 0 HD3 PRO A 51 9.894 -5.664 -8.978 1.00 0.00 H new ATOM 714 N VAL A 52 5.054 -6.812 -6.738 1.00 0.00 N ATOM 715 CA VAL A 52 4.072 -7.837 -6.406 1.00 0.00 C ATOM 716 C VAL A 52 2.687 -7.196 -6.384 1.00 0.00 C ATOM 717 O VAL A 52 2.559 -5.989 -6.169 1.00 0.00 O ATOM 718 CB VAL A 52 4.500 -8.535 -5.095 1.00 0.00 C ATOM 719 CG1 VAL A 52 4.562 -7.571 -3.904 1.00 0.00 C ATOM 720 CG2 VAL A 52 3.614 -9.737 -4.740 1.00 0.00 C ATOM 0 H VAL A 52 4.939 -5.958 -6.193 1.00 0.00 H new ATOM 0 HA VAL A 52 4.021 -8.628 -7.154 1.00 0.00 H new ATOM 0 HB VAL A 52 5.507 -8.903 -5.293 1.00 0.00 H new ATOM 0 HG11 VAL A 52 4.868 -8.116 -3.011 1.00 0.00 H new ATOM 0 HG12 VAL A 52 5.284 -6.781 -4.112 1.00 0.00 H new ATOM 0 HG13 VAL A 52 3.579 -7.130 -3.741 1.00 0.00 H new ATOM 0 HG21 VAL A 52 3.964 -10.185 -3.810 1.00 0.00 H new ATOM 0 HG22 VAL A 52 2.583 -9.405 -4.617 1.00 0.00 H new ATOM 0 HG23 VAL A 52 3.665 -10.475 -5.540 1.00 0.00 H new ATOM 730 N ILE A 53 1.658 -8.005 -6.627 1.00 0.00 N ATOM 731 CA ILE A 53 0.261 -7.608 -6.625 1.00 0.00 C ATOM 732 C ILE A 53 -0.383 -8.416 -5.509 1.00 0.00 C ATOM 733 O ILE A 53 -0.323 -9.648 -5.546 1.00 0.00 O ATOM 734 CB ILE A 53 -0.401 -7.899 -7.987 1.00 0.00 C ATOM 735 CG1 ILE A 53 0.394 -7.397 -9.209 1.00 0.00 C ATOM 736 CG2 ILE A 53 -1.835 -7.340 -8.007 1.00 0.00 C ATOM 737 CD1 ILE A 53 0.778 -5.920 -9.209 1.00 0.00 C ATOM 0 H ILE A 53 1.785 -8.995 -6.839 1.00 0.00 H new ATOM 0 HA ILE A 53 0.143 -6.537 -6.462 1.00 0.00 H new ATOM 0 HB ILE A 53 -0.417 -8.985 -8.083 1.00 0.00 H new ATOM 0 HG12 ILE A 53 1.307 -7.987 -9.289 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -0.194 -7.597 -10.105 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -2.294 -7.550 -8.973 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -2.420 -7.811 -7.217 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -1.808 -6.262 -7.845 1.00 0.00 H new ATOM 0 HD11 ILE A 53 1.333 -5.688 -10.118 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -0.124 -5.310 -9.169 1.00 0.00 H new ATOM 0 HD13 ILE A 53 1.400 -5.706 -8.340 1.00 0.00 H new ATOM 749 N LEU A 54 -0.953 -7.745 -4.512 1.00 0.00 N ATOM 750 CA LEU A 54 -1.714 -8.407 -3.463 1.00 0.00 C ATOM 751 C LEU A 54 -3.161 -8.535 -3.915 1.00 0.00 C ATOM 752 O LEU A 54 -3.728 -7.592 -4.475 1.00 0.00 O ATOM 753 CB LEU A 54 -1.593 -7.637 -2.138 1.00 0.00 C ATOM 754 CG LEU A 54 -0.187 -7.726 -1.507 1.00 0.00 C ATOM 755 CD1 LEU A 54 -0.164 -6.947 -0.186 1.00 0.00 C ATOM 756 CD2 LEU A 54 0.268 -9.170 -1.253 1.00 0.00 C ATOM 0 H LEU A 54 -0.899 -6.731 -4.411 1.00 0.00 H new ATOM 0 HA LEU A 54 -1.314 -9.405 -3.284 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -1.841 -6.590 -2.310 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -2.326 -8.026 -1.431 1.00 0.00 H new ATOM 0 HG LEU A 54 0.509 -7.291 -2.224 1.00 0.00 H new ATOM 0 HD11 LEU A 54 0.830 -7.012 0.257 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -0.410 -5.902 -0.375 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -0.896 -7.373 0.500 1.00 0.00 H new ATOM 0 HD21 LEU A 54 1.263 -9.165 -0.809 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -0.431 -9.657 -0.573 1.00 0.00 H new ATOM 0 HD23 LEU A 54 0.295 -9.714 -2.197 1.00 0.00 H new ATOM 768 N SER A 55 -3.738 -9.711 -3.682 1.00 0.00 N ATOM 769 CA SER A 55 -5.149 -10.025 -3.849 1.00 0.00 C ATOM 770 C SER A 55 -5.938 -9.415 -2.678 1.00 0.00 C ATOM 771 O SER A 55 -5.355 -8.956 -1.689 1.00 0.00 O ATOM 772 CB SER A 55 -5.341 -11.560 -3.907 1.00 0.00 C ATOM 773 OG SER A 55 -4.129 -12.307 -3.990 1.00 0.00 O ATOM 0 H SER A 55 -3.201 -10.513 -3.353 1.00 0.00 H new ATOM 0 HA SER A 55 -5.520 -9.603 -4.783 1.00 0.00 H new ATOM 0 HB2 SER A 55 -5.889 -11.878 -3.020 1.00 0.00 H new ATOM 0 HB3 SER A 55 -5.962 -11.803 -4.769 1.00 0.00 H new ATOM 0 HG SER A 55 -4.094 -12.956 -3.256 1.00 0.00 H new ATOM 779 N ASP A 56 -7.268 -9.437 -2.742 1.00 0.00 N ATOM 780 CA ASP A 56 -8.124 -9.195 -1.580 1.00 0.00 C ATOM 781 C ASP A 56 -7.860 -10.252 -0.511 1.00 0.00 C ATOM 782 O ASP A 56 -7.826 -9.932 0.666 1.00 0.00 O ATOM 783 CB ASP A 56 -9.603 -9.243 -1.984 1.00 0.00 C ATOM 784 CG ASP A 56 -10.497 -9.001 -0.766 1.00 0.00 C ATOM 785 OD1 ASP A 56 -10.431 -7.874 -0.227 1.00 0.00 O ATOM 786 OD2 ASP A 56 -11.286 -9.900 -0.378 1.00 0.00 O ATOM 0 H ASP A 56 -7.784 -9.623 -3.602 1.00 0.00 H new ATOM 0 HA ASP A 56 -7.895 -8.206 -1.183 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -9.803 -8.489 -2.745 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -9.834 -10.212 -2.426 1.00 0.00 H new ATOM 791 N GLU A 57 -7.577 -11.494 -0.911 1.00 0.00 N ATOM 792 CA GLU A 57 -7.336 -12.624 -0.013 1.00 0.00 C ATOM 793 C GLU A 57 -6.150 -12.369 0.922 1.00 0.00 C ATOM 794 O GLU A 57 -6.079 -12.951 2.000 1.00 0.00 O ATOM 795 CB GLU A 57 -7.024 -13.856 -0.872 1.00 0.00 C ATOM 796 CG GLU A 57 -8.270 -14.480 -1.508 1.00 0.00 C ATOM 797 CD GLU A 57 -9.073 -15.318 -0.519 1.00 0.00 C ATOM 798 OE1 GLU A 57 -8.552 -16.359 -0.048 1.00 0.00 O ATOM 799 OE2 GLU A 57 -10.238 -14.958 -0.259 1.00 0.00 O ATOM 0 H GLU A 57 -7.507 -11.748 -1.897 1.00 0.00 H new ATOM 0 HA GLU A 57 -8.224 -12.772 0.602 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -6.325 -13.574 -1.659 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -6.525 -14.604 -0.255 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -8.904 -13.689 -1.908 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -7.970 -15.105 -2.349 1.00 0.00 H new ATOM 806 N GLU A 58 -5.213 -11.517 0.513 1.00 0.00 N ATOM 807 CA GLU A 58 -4.009 -11.183 1.263 1.00 0.00 C ATOM 808 C GLU A 58 -4.251 -9.973 2.162 1.00 0.00 C ATOM 809 O GLU A 58 -3.597 -9.829 3.194 1.00 0.00 O ATOM 810 CB GLU A 58 -2.834 -10.867 0.317 1.00 0.00 C ATOM 811 CG GLU A 58 -2.880 -11.562 -1.053 1.00 0.00 C ATOM 812 CD GLU A 58 -2.941 -13.083 -0.991 1.00 0.00 C ATOM 813 OE1 GLU A 58 -2.205 -13.675 -0.167 1.00 0.00 O ATOM 814 OE2 GLU A 58 -3.739 -13.646 -1.776 1.00 0.00 O ATOM 0 H GLU A 58 -5.275 -11.025 -0.379 1.00 0.00 H new ATOM 0 HA GLU A 58 -3.758 -12.051 1.873 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -2.799 -9.789 0.157 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -1.905 -11.145 0.815 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -3.749 -11.199 -1.601 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -1.999 -11.270 -1.624 1.00 0.00 H new ATOM 821 N LEU A 59 -5.168 -9.092 1.753 1.00 0.00 N ATOM 822 CA LEU A 59 -5.378 -7.783 2.357 1.00 0.00 C ATOM 823 C LEU A 59 -6.720 -7.646 3.063 1.00 0.00 C ATOM 824 O LEU A 59 -7.024 -6.578 3.592 1.00 0.00 O ATOM 825 CB LEU A 59 -5.172 -6.696 1.300 1.00 0.00 C ATOM 826 CG LEU A 59 -3.690 -6.338 1.109 1.00 0.00 C ATOM 827 CD1 LEU A 59 -3.556 -5.370 -0.060 1.00 0.00 C ATOM 828 CD2 LEU A 59 -3.093 -5.645 2.340 1.00 0.00 C ATOM 0 H LEU A 59 -5.798 -9.279 0.973 1.00 0.00 H new ATOM 0 HA LEU A 59 -4.636 -7.662 3.147 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -5.587 -7.033 0.350 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -5.725 -5.802 1.590 1.00 0.00 H new ATOM 0 HG LEU A 59 -3.157 -7.273 0.934 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -2.506 -5.112 -0.200 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -3.939 -5.839 -0.966 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -4.127 -4.465 0.149 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -2.044 -5.413 2.154 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -3.639 -4.723 2.539 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -3.171 -6.306 3.203 1.00 0.00 H new ATOM 840 N ALA A 60 -7.490 -8.724 3.147 1.00 0.00 N ATOM 841 CA ALA A 60 -8.685 -8.918 3.948 1.00 0.00 C ATOM 842 C ALA A 60 -8.350 -8.948 5.451 1.00 0.00 C ATOM 843 O ALA A 60 -8.824 -9.803 6.199 1.00 0.00 O ATOM 844 CB ALA A 60 -9.348 -10.207 3.465 1.00 0.00 C ATOM 0 H ALA A 60 -7.270 -9.560 2.605 1.00 0.00 H new ATOM 0 HA ALA A 60 -9.378 -8.085 3.825 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -10.253 -10.390 4.044 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -9.605 -10.111 2.410 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -8.659 -11.042 3.596 1.00 0.00 H new ATOM 850 N VAL A 61 -7.527 -8.004 5.889 1.00 0.00 N ATOM 851 CA VAL A 61 -7.138 -7.689 7.248 1.00 0.00 C ATOM 852 C VAL A 61 -7.558 -6.252 7.546 1.00 0.00 C ATOM 853 O VAL A 61 -7.740 -5.451 6.625 1.00 0.00 O ATOM 854 CB VAL A 61 -5.618 -7.876 7.427 1.00 0.00 C ATOM 855 CG1 VAL A 61 -5.260 -9.361 7.424 1.00 0.00 C ATOM 856 CG2 VAL A 61 -4.762 -7.141 6.383 1.00 0.00 C ATOM 0 H VAL A 61 -7.070 -7.377 5.227 1.00 0.00 H new ATOM 0 HA VAL A 61 -7.632 -8.362 7.949 1.00 0.00 H new ATOM 0 HB VAL A 61 -5.383 -7.425 8.391 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -4.184 -9.476 7.551 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -5.778 -9.862 8.242 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -5.563 -9.806 6.476 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -3.706 -7.326 6.582 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -5.012 -7.505 5.386 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -4.960 -6.071 6.439 1.00 0.00 H new ATOM 866 N GLU A 62 -7.665 -5.884 8.821 1.00 0.00 N ATOM 867 CA GLU A 62 -7.855 -4.491 9.226 1.00 0.00 C ATOM 868 C GLU A 62 -6.700 -3.613 8.748 1.00 0.00 C ATOM 869 O GLU A 62 -6.920 -2.523 8.227 1.00 0.00 O ATOM 870 CB GLU A 62 -7.987 -4.351 10.752 1.00 0.00 C ATOM 871 CG GLU A 62 -6.986 -5.223 11.531 1.00 0.00 C ATOM 872 CD GLU A 62 -6.243 -4.551 12.699 1.00 0.00 C ATOM 873 OE1 GLU A 62 -6.656 -3.482 13.214 1.00 0.00 O ATOM 874 OE2 GLU A 62 -5.173 -5.086 13.084 1.00 0.00 O ATOM 0 H GLU A 62 -7.623 -6.540 9.601 1.00 0.00 H new ATOM 0 HA GLU A 62 -8.783 -4.159 8.760 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -7.841 -3.307 11.028 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -9.001 -4.620 11.049 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -7.521 -6.088 11.922 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -6.243 -5.599 10.827 1.00 0.00 H new ATOM 881 N LYS A 63 -5.451 -4.058 8.900 1.00 0.00 N ATOM 882 CA LYS A 63 -4.286 -3.253 8.563 1.00 0.00 C ATOM 883 C LYS A 63 -3.124 -4.170 8.233 1.00 0.00 C ATOM 884 O LYS A 63 -3.053 -5.261 8.809 1.00 0.00 O ATOM 885 CB LYS A 63 -4.007 -2.286 9.736 1.00 0.00 C ATOM 886 CG LYS A 63 -2.643 -1.564 9.745 1.00 0.00 C ATOM 887 CD LYS A 63 -1.627 -2.314 10.600 1.00 0.00 C ATOM 888 CE LYS A 63 -0.299 -1.564 10.702 1.00 0.00 C ATOM 889 NZ LYS A 63 0.101 -1.412 12.115 1.00 0.00 N ATOM 0 H LYS A 63 -5.224 -4.985 9.260 1.00 0.00 H new ATOM 0 HA LYS A 63 -4.454 -2.642 7.676 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -4.790 -1.528 9.743 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -4.098 -2.847 10.666 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -2.269 -1.475 8.725 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -2.767 -0.551 10.128 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -2.035 -2.465 11.599 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -1.453 -3.302 10.174 1.00 0.00 H new ATOM 0 HE2 LYS A 63 0.474 -2.104 10.155 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -0.392 -0.583 10.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 1.005 -0.900 12.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -0.629 -0.877 12.627 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 0.209 -2.351 12.548 1.00 0.00 H new ATOM 903 N VAL A 64 -2.187 -3.727 7.390 1.00 0.00 N ATOM 904 CA VAL A 64 -0.850 -4.305 7.357 1.00 0.00 C ATOM 905 C VAL A 64 0.183 -3.188 7.120 1.00 0.00 C ATOM 906 O VAL A 64 -0.162 -2.057 6.776 1.00 0.00 O ATOM 907 CB VAL A 64 -0.825 -5.525 6.404 1.00 0.00 C ATOM 908 CG1 VAL A 64 -0.987 -5.169 4.929 1.00 0.00 C ATOM 909 CG2 VAL A 64 0.407 -6.414 6.591 1.00 0.00 C ATOM 0 H VAL A 64 -2.334 -2.970 6.723 1.00 0.00 H new ATOM 0 HA VAL A 64 -0.554 -4.734 8.315 1.00 0.00 H new ATOM 0 HB VAL A 64 -1.707 -6.094 6.700 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -0.958 -6.079 4.330 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -1.942 -4.666 4.779 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -0.176 -4.508 4.623 1.00 0.00 H new ATOM 0 HG21 VAL A 64 0.362 -7.250 5.893 1.00 0.00 H new ATOM 0 HG22 VAL A 64 1.308 -5.831 6.401 1.00 0.00 H new ATOM 0 HG23 VAL A 64 0.429 -6.795 7.612 1.00 0.00 H new ATOM 919 N THR A 65 1.452 -3.494 7.359 1.00 0.00 N ATOM 920 CA THR A 65 2.627 -2.694 7.038 1.00 0.00 C ATOM 921 C THR A 65 3.371 -3.459 5.937 1.00 0.00 C ATOM 922 O THR A 65 3.413 -4.687 5.986 1.00 0.00 O ATOM 923 CB THR A 65 3.507 -2.537 8.296 1.00 0.00 C ATOM 924 OG1 THR A 65 2.771 -2.092 9.428 1.00 0.00 O ATOM 925 CG2 THR A 65 4.673 -1.567 8.105 1.00 0.00 C ATOM 0 H THR A 65 1.705 -4.371 7.815 1.00 0.00 H new ATOM 0 HA THR A 65 2.363 -1.691 6.702 1.00 0.00 H new ATOM 0 HB THR A 65 3.893 -3.542 8.467 1.00 0.00 H new ATOM 0 HG1 THR A 65 3.372 -2.010 10.198 1.00 0.00 H new ATOM 0 HG21 THR A 65 5.249 -1.505 9.028 1.00 0.00 H new ATOM 0 HG22 THR A 65 5.315 -1.924 7.300 1.00 0.00 H new ATOM 0 HG23 THR A 65 4.287 -0.580 7.851 1.00 0.00 H new ATOM 933 N LEU A 66 3.965 -2.780 4.956 1.00 0.00 N ATOM 934 CA LEU A 66 4.873 -3.373 3.981 1.00 0.00 C ATOM 935 C LEU A 66 6.169 -2.600 4.079 1.00 0.00 C ATOM 936 O LEU A 66 6.173 -1.370 4.102 1.00 0.00 O ATOM 937 CB LEU A 66 4.356 -3.305 2.532 1.00 0.00 C ATOM 938 CG LEU A 66 3.207 -4.252 2.149 1.00 0.00 C ATOM 939 CD1 LEU A 66 3.468 -5.703 2.557 1.00 0.00 C ATOM 940 CD2 LEU A 66 1.875 -3.798 2.744 1.00 0.00 C ATOM 0 H LEU A 66 3.823 -1.780 4.816 1.00 0.00 H new ATOM 0 HA LEU A 66 4.985 -4.433 4.210 1.00 0.00 H new ATOM 0 HB2 LEU A 66 4.030 -2.283 2.338 1.00 0.00 H new ATOM 0 HB3 LEU A 66 5.194 -3.505 1.865 1.00 0.00 H new ATOM 0 HG LEU A 66 3.152 -4.209 1.061 1.00 0.00 H new ATOM 0 HD11 LEU A 66 2.622 -6.322 2.260 1.00 0.00 H new ATOM 0 HD12 LEU A 66 4.371 -6.063 2.064 1.00 0.00 H new ATOM 0 HD13 LEU A 66 3.597 -5.759 3.638 1.00 0.00 H new ATOM 0 HD21 LEU A 66 1.089 -4.494 2.450 1.00 0.00 H new ATOM 0 HD22 LEU A 66 1.951 -3.775 3.831 1.00 0.00 H new ATOM 0 HD23 LEU A 66 1.633 -2.801 2.376 1.00 0.00 H new ATOM 952 N SER A 67 7.275 -3.322 4.135 1.00 0.00 N ATOM 953 CA SER A 67 8.593 -2.746 4.337 1.00 0.00 C ATOM 954 C SER A 67 9.608 -3.531 3.507 1.00 0.00 C ATOM 955 O SER A 67 9.224 -4.493 2.842 1.00 0.00 O ATOM 956 CB SER A 67 8.925 -2.732 5.834 1.00 0.00 C ATOM 957 OG SER A 67 7.779 -2.742 6.671 1.00 0.00 O ATOM 0 H SER A 67 7.283 -4.338 4.040 1.00 0.00 H new ATOM 0 HA SER A 67 8.624 -1.710 3.999 1.00 0.00 H new ATOM 0 HB2 SER A 67 9.543 -3.599 6.068 1.00 0.00 H new ATOM 0 HB3 SER A 67 9.520 -1.846 6.057 1.00 0.00 H new ATOM 0 HG SER A 67 8.060 -2.734 7.610 1.00 0.00 H new ATOM 963 N THR A 68 10.882 -3.142 3.512 1.00 0.00 N ATOM 964 CA THR A 68 11.892 -3.798 2.689 1.00 0.00 C ATOM 965 C THR A 68 13.008 -4.417 3.504 1.00 0.00 C ATOM 966 O THR A 68 13.469 -3.840 4.489 1.00 0.00 O ATOM 967 CB THR A 68 12.489 -2.811 1.691 1.00 0.00 C ATOM 968 OG1 THR A 68 12.713 -1.540 2.281 1.00 0.00 O ATOM 969 CG2 THR A 68 11.563 -2.663 0.488 1.00 0.00 C ATOM 0 H THR A 68 11.238 -2.373 4.080 1.00 0.00 H new ATOM 0 HA THR A 68 11.381 -4.605 2.164 1.00 0.00 H new ATOM 0 HB THR A 68 13.452 -3.207 1.369 1.00 0.00 H new ATOM 0 HG1 THR A 68 13.629 -1.248 2.091 1.00 0.00 H new ATOM 0 HG21 THR A 68 11.996 -1.957 -0.220 1.00 0.00 H new ATOM 0 HG22 THR A 68 11.438 -3.631 0.004 1.00 0.00 H new ATOM 0 HG23 THR A 68 10.592 -2.295 0.819 1.00 0.00 H new ATOM 977 N THR A 69 13.529 -5.523 2.983 1.00 0.00 N ATOM 978 CA THR A 69 14.619 -6.280 3.574 1.00 0.00 C ATOM 979 C THR A 69 15.979 -5.564 3.472 1.00 0.00 C ATOM 980 O THR A 69 16.970 -5.969 4.091 1.00 0.00 O ATOM 981 CB THR A 69 14.661 -7.644 2.863 1.00 0.00 C ATOM 982 OG1 THR A 69 14.863 -7.460 1.470 1.00 0.00 O ATOM 983 CG2 THR A 69 13.370 -8.460 3.033 1.00 0.00 C ATOM 0 H THR A 69 13.191 -5.927 2.110 1.00 0.00 H new ATOM 0 HA THR A 69 14.436 -6.394 4.643 1.00 0.00 H new ATOM 0 HB THR A 69 15.481 -8.193 3.325 1.00 0.00 H new ATOM 0 HG1 THR A 69 14.890 -8.333 1.025 1.00 0.00 H new ATOM 0 HG21 THR A 69 13.468 -9.410 2.507 1.00 0.00 H new ATOM 0 HG22 THR A 69 13.195 -8.648 4.092 1.00 0.00 H new ATOM 0 HG23 THR A 69 12.530 -7.902 2.620 1.00 0.00 H new ATOM 991 N GLY A 70 16.069 -4.510 2.664 1.00 0.00 N ATOM 992 CA GLY A 70 17.321 -3.931 2.225 1.00 0.00 C ATOM 993 C GLY A 70 17.089 -2.563 1.616 1.00 0.00 C ATOM 994 O GLY A 70 16.013 -1.980 1.733 1.00 0.00 O ATOM 0 H GLY A 70 15.250 -4.029 2.292 1.00 0.00 H new ATOM 0 HA2 GLY A 70 18.006 -3.848 3.069 1.00 0.00 H new ATOM 0 HA3 GLY A 70 17.794 -4.586 1.493 1.00 0.00 H new ATOM 998 N LYS A 71 18.139 -2.043 0.993 1.00 0.00 N ATOM 999 CA LYS A 71 18.196 -0.725 0.389 1.00 0.00 C ATOM 1000 C LYS A 71 17.062 -0.582 -0.618 1.00 0.00 C ATOM 1001 O LYS A 71 17.048 -1.294 -1.619 1.00 0.00 O ATOM 1002 CB LYS A 71 19.561 -0.557 -0.282 1.00 0.00 C ATOM 1003 CG LYS A 71 20.010 0.902 -0.351 1.00 0.00 C ATOM 1004 CD LYS A 71 21.120 1.000 -1.394 1.00 0.00 C ATOM 1005 CE LYS A 71 20.472 1.097 -2.773 1.00 0.00 C ATOM 1006 NZ LYS A 71 21.457 0.907 -3.861 1.00 0.00 N ATOM 0 H LYS A 71 19.014 -2.557 0.892 1.00 0.00 H new ATOM 0 HA LYS A 71 18.076 0.053 1.143 1.00 0.00 H new ATOM 0 HB2 LYS A 71 20.304 -1.136 0.266 1.00 0.00 H new ATOM 0 HB3 LYS A 71 19.518 -0.968 -1.291 1.00 0.00 H new ATOM 0 HG2 LYS A 71 19.174 1.547 -0.622 1.00 0.00 H new ATOM 0 HG3 LYS A 71 20.369 1.237 0.622 1.00 0.00 H new ATOM 0 HD2 LYS A 71 21.743 1.874 -1.205 1.00 0.00 H new ATOM 0 HD3 LYS A 71 21.770 0.127 -1.340 1.00 0.00 H new ATOM 0 HE2 LYS A 71 19.687 0.346 -2.859 1.00 0.00 H new ATOM 0 HE3 LYS A 71 19.994 2.071 -2.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 20.968 0.578 -4.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 21.933 1.810 -4.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 22.162 0.200 -3.571 1.00 0.00 H new ATOM 1020 N ALA A 72 16.134 0.328 -0.356 1.00 0.00 N ATOM 1021 CA ALA A 72 14.987 0.578 -1.209 1.00 0.00 C ATOM 1022 C ALA A 72 15.173 1.951 -1.828 1.00 0.00 C ATOM 1023 O ALA A 72 15.712 2.837 -1.158 1.00 0.00 O ATOM 1024 CB ALA A 72 13.688 0.511 -0.410 1.00 0.00 C ATOM 0 H ALA A 72 16.161 0.923 0.472 1.00 0.00 H new ATOM 0 HA ALA A 72 14.918 -0.183 -1.986 1.00 0.00 H new ATOM 0 HB1 ALA A 72 12.843 0.702 -1.072 1.00 0.00 H new ATOM 0 HB2 ALA A 72 13.585 -0.479 0.034 1.00 0.00 H new ATOM 0 HB3 ALA A 72 13.707 1.262 0.379 1.00 0.00 H new ATOM 1030 N ILE A 73 14.733 2.142 -3.072 1.00 0.00 N ATOM 1031 CA ILE A 73 14.887 3.441 -3.745 1.00 0.00 C ATOM 1032 C ILE A 73 13.582 3.913 -4.385 1.00 0.00 C ATOM 1033 O ILE A 73 13.476 5.088 -4.715 1.00 0.00 O ATOM 1034 CB ILE A 73 16.065 3.431 -4.756 1.00 0.00 C ATOM 1035 CG1 ILE A 73 17.192 2.484 -4.290 1.00 0.00 C ATOM 1036 CG2 ILE A 73 16.594 4.858 -4.990 1.00 0.00 C ATOM 1037 CD1 ILE A 73 18.481 2.559 -5.090 1.00 0.00 C ATOM 0 H ILE A 73 14.272 1.426 -3.633 1.00 0.00 H new ATOM 0 HA ILE A 73 15.138 4.171 -2.975 1.00 0.00 H new ATOM 0 HB ILE A 73 15.692 3.051 -5.707 1.00 0.00 H new ATOM 0 HG12 ILE A 73 17.419 2.703 -3.247 1.00 0.00 H new ATOM 0 HG13 ILE A 73 16.821 1.460 -4.327 1.00 0.00 H new ATOM 0 HG21 ILE A 73 17.419 4.828 -5.702 1.00 0.00 H new ATOM 0 HG22 ILE A 73 15.794 5.482 -5.388 1.00 0.00 H new ATOM 0 HG23 ILE A 73 16.944 5.276 -4.046 1.00 0.00 H new ATOM 0 HD11 ILE A 73 19.205 1.855 -4.680 1.00 0.00 H new ATOM 0 HD12 ILE A 73 18.278 2.307 -6.131 1.00 0.00 H new ATOM 0 HD13 ILE A 73 18.886 3.569 -5.034 1.00 0.00 H new ATOM 1049 N GLU A 74 12.553 3.072 -4.485 1.00 0.00 N ATOM 1050 CA GLU A 74 11.250 3.466 -5.004 1.00 0.00 C ATOM 1051 C GLU A 74 10.211 2.691 -4.205 1.00 0.00 C ATOM 1052 O GLU A 74 10.443 1.502 -3.994 1.00 0.00 O ATOM 1053 CB GLU A 74 11.123 3.120 -6.503 1.00 0.00 C ATOM 1054 CG GLU A 74 12.173 3.807 -7.389 1.00 0.00 C ATOM 1055 CD GLU A 74 12.090 3.386 -8.854 1.00 0.00 C ATOM 1056 OE1 GLU A 74 12.589 2.280 -9.169 1.00 0.00 O ATOM 1057 OE2 GLU A 74 11.634 4.177 -9.709 1.00 0.00 O ATOM 0 H GLU A 74 12.604 2.092 -4.205 1.00 0.00 H new ATOM 0 HA GLU A 74 11.111 4.543 -4.907 1.00 0.00 H new ATOM 0 HB2 GLU A 74 11.208 2.040 -6.626 1.00 0.00 H new ATOM 0 HB3 GLU A 74 10.129 3.403 -6.849 1.00 0.00 H new ATOM 0 HG2 GLU A 74 12.047 4.887 -7.320 1.00 0.00 H new ATOM 0 HG3 GLU A 74 13.168 3.577 -7.007 1.00 0.00 H new ATOM 1064 N PHE A 75 9.104 3.325 -3.801 1.00 0.00 N ATOM 1065 CA PHE A 75 7.876 2.705 -3.287 1.00 0.00 C ATOM 1066 C PHE A 75 6.761 3.258 -4.157 1.00 0.00 C ATOM 1067 O PHE A 75 6.320 4.391 -3.952 1.00 0.00 O ATOM 1068 CB PHE A 75 7.574 2.999 -1.788 1.00 0.00 C ATOM 1069 CG PHE A 75 7.849 1.874 -0.803 1.00 0.00 C ATOM 1070 CD1 PHE A 75 9.015 1.110 -0.980 1.00 0.00 C ATOM 1071 CD2 PHE A 75 7.025 1.640 0.332 1.00 0.00 C ATOM 1072 CE1 PHE A 75 9.387 0.127 -0.061 1.00 0.00 C ATOM 1073 CE2 PHE A 75 7.472 0.708 1.294 1.00 0.00 C ATOM 1074 CZ PHE A 75 8.626 -0.062 1.096 1.00 0.00 C ATOM 0 H PHE A 75 9.037 4.343 -3.825 1.00 0.00 H new ATOM 0 HA PHE A 75 7.978 1.621 -3.331 1.00 0.00 H new ATOM 0 HB2 PHE A 75 8.161 3.866 -1.486 1.00 0.00 H new ATOM 0 HB3 PHE A 75 6.524 3.279 -1.701 1.00 0.00 H new ATOM 0 HD1 PHE A 75 9.637 1.287 -1.845 1.00 0.00 H new ATOM 0 HD2 PHE A 75 6.086 2.159 0.455 1.00 0.00 H new ATOM 0 HE1 PHE A 75 10.258 -0.484 -0.243 1.00 0.00 H new ATOM 0 HE2 PHE A 75 6.909 0.585 2.207 1.00 0.00 H new ATOM 0 HZ PHE A 75 8.925 -0.795 1.831 1.00 0.00 H new ATOM 1084 N ALA A 76 6.316 2.477 -5.136 1.00 0.00 N ATOM 1085 CA ALA A 76 5.049 2.764 -5.783 1.00 0.00 C ATOM 1086 C ALA A 76 3.938 2.049 -5.018 1.00 0.00 C ATOM 1087 O ALA A 76 4.175 0.997 -4.408 1.00 0.00 O ATOM 1088 CB ALA A 76 5.101 2.356 -7.252 1.00 0.00 C ATOM 0 H ALA A 76 6.806 1.656 -5.491 1.00 0.00 H new ATOM 0 HA ALA A 76 4.843 3.834 -5.765 1.00 0.00 H new ATOM 0 HB1 ALA A 76 4.144 2.577 -7.725 1.00 0.00 H new ATOM 0 HB2 ALA A 76 5.892 2.911 -7.756 1.00 0.00 H new ATOM 0 HB3 ALA A 76 5.304 1.288 -7.326 1.00 0.00 H new ATOM 1094 N VAL A 77 2.735 2.611 -5.094 1.00 0.00 N ATOM 1095 CA VAL A 77 1.491 2.030 -4.624 1.00 0.00 C ATOM 1096 C VAL A 77 0.433 2.407 -5.662 1.00 0.00 C ATOM 1097 O VAL A 77 0.245 3.598 -5.932 1.00 0.00 O ATOM 1098 CB VAL A 77 1.096 2.562 -3.224 1.00 0.00 C ATOM 1099 CG1 VAL A 77 0.063 1.609 -2.613 1.00 0.00 C ATOM 1100 CG2 VAL A 77 2.250 2.719 -2.223 1.00 0.00 C ATOM 0 H VAL A 77 2.600 3.533 -5.508 1.00 0.00 H new ATOM 0 HA VAL A 77 1.589 0.950 -4.516 1.00 0.00 H new ATOM 0 HB VAL A 77 0.709 3.567 -3.395 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -0.226 1.970 -1.626 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -0.817 1.566 -3.255 1.00 0.00 H new ATOM 0 HG13 VAL A 77 0.496 0.613 -2.523 1.00 0.00 H new ATOM 0 HG21 VAL A 77 1.862 3.097 -1.277 1.00 0.00 H new ATOM 0 HG22 VAL A 77 2.724 1.751 -2.060 1.00 0.00 H new ATOM 0 HG23 VAL A 77 2.984 3.420 -2.621 1.00 0.00 H new ATOM 1110 N SER A 78 -0.267 1.436 -6.245 1.00 0.00 N ATOM 1111 CA SER A 78 -1.501 1.709 -6.979 1.00 0.00 C ATOM 1112 C SER A 78 -2.533 0.600 -6.751 1.00 0.00 C ATOM 1113 O SER A 78 -2.211 -0.403 -6.115 1.00 0.00 O ATOM 1114 CB SER A 78 -1.225 2.040 -8.453 1.00 0.00 C ATOM 1115 OG SER A 78 -0.329 1.157 -9.101 1.00 0.00 O ATOM 0 H SER A 78 -0.000 0.452 -6.223 1.00 0.00 H new ATOM 0 HA SER A 78 -1.957 2.614 -6.577 1.00 0.00 H new ATOM 0 HB2 SER A 78 -2.171 2.038 -8.995 1.00 0.00 H new ATOM 0 HB3 SER A 78 -0.825 3.052 -8.515 1.00 0.00 H new ATOM 0 HG SER A 78 -0.210 1.437 -10.033 1.00 0.00 H new ATOM 1121 N GLY A 79 -3.782 0.785 -7.191 1.00 0.00 N ATOM 1122 CA GLY A 79 -4.829 -0.229 -7.106 1.00 0.00 C ATOM 1123 C GLY A 79 -6.172 0.410 -6.784 1.00 0.00 C ATOM 1124 O GLY A 79 -7.011 0.565 -7.667 1.00 0.00 O ATOM 0 H GLY A 79 -4.094 1.656 -7.621 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -4.895 -0.770 -8.050 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -4.574 -0.958 -6.337 1.00 0.00 H new ATOM 1128 N GLY A 80 -6.376 0.802 -5.527 1.00 0.00 N ATOM 1129 CA GLY A 80 -7.657 1.311 -5.053 1.00 0.00 C ATOM 1130 C GLY A 80 -8.676 0.175 -5.006 1.00 0.00 C ATOM 1131 O GLY A 80 -8.297 -0.969 -4.730 1.00 0.00 O ATOM 0 H GLY A 80 -5.653 0.774 -4.808 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -7.541 1.750 -4.062 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -8.011 2.103 -5.713 1.00 0.00 H new ATOM 1135 N VAL A 81 -9.961 0.503 -5.154 1.00 0.00 N ATOM 1136 CA VAL A 81 -11.065 -0.443 -5.068 1.00 0.00 C ATOM 1137 C VAL A 81 -12.307 0.116 -5.774 1.00 0.00 C ATOM 1138 O VAL A 81 -12.472 1.330 -5.897 1.00 0.00 O ATOM 1139 CB VAL A 81 -11.325 -0.771 -3.580 1.00 0.00 C ATOM 1140 CG1 VAL A 81 -11.685 0.416 -2.683 1.00 0.00 C ATOM 1141 CG2 VAL A 81 -12.399 -1.824 -3.372 1.00 0.00 C ATOM 0 H VAL A 81 -10.266 1.458 -5.341 1.00 0.00 H new ATOM 0 HA VAL A 81 -10.811 -1.371 -5.581 1.00 0.00 H new ATOM 0 HB VAL A 81 -10.346 -1.143 -3.277 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -11.845 0.066 -1.663 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -10.871 1.141 -2.695 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -12.596 0.888 -3.052 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -12.529 -2.005 -2.305 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -13.339 -1.474 -3.798 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -12.100 -2.750 -3.863 1.00 0.00 H new ATOM 1151 N VAL A 82 -13.200 -0.786 -6.178 1.00 0.00 N ATOM 1152 CA VAL A 82 -14.616 -0.592 -6.439 1.00 0.00 C ATOM 1153 C VAL A 82 -15.281 -1.882 -5.955 1.00 0.00 C ATOM 1154 O VAL A 82 -14.574 -2.865 -5.683 1.00 0.00 O ATOM 1155 CB VAL A 82 -14.809 -0.303 -7.944 1.00 0.00 C ATOM 1156 CG1 VAL A 82 -14.508 -1.509 -8.845 1.00 0.00 C ATOM 1157 CG2 VAL A 82 -16.218 0.198 -8.254 1.00 0.00 C ATOM 0 H VAL A 82 -12.922 -1.753 -6.344 1.00 0.00 H new ATOM 0 HA VAL A 82 -15.063 0.258 -5.924 1.00 0.00 H new ATOM 0 HB VAL A 82 -14.081 0.477 -8.167 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -14.665 -1.232 -9.888 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -13.473 -1.819 -8.704 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -15.173 -2.333 -8.584 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -16.309 0.389 -9.323 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -16.946 -0.557 -7.956 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -16.406 1.120 -7.704 1.00 0.00 H new ATOM 1167 N ASP A 83 -16.608 -1.925 -5.881 1.00 0.00 N ATOM 1168 CA ASP A 83 -17.311 -3.182 -5.725 1.00 0.00 C ATOM 1169 C ASP A 83 -17.992 -3.545 -7.037 1.00 0.00 C ATOM 1170 O ASP A 83 -18.414 -2.670 -7.800 1.00 0.00 O ATOM 1171 CB ASP A 83 -18.272 -3.133 -4.545 1.00 0.00 C ATOM 1172 CG ASP A 83 -18.441 -4.579 -4.097 1.00 0.00 C ATOM 1173 OD1 ASP A 83 -17.488 -5.133 -3.509 1.00 0.00 O ATOM 1174 OD2 ASP A 83 -19.438 -5.230 -4.471 1.00 0.00 O ATOM 0 H ASP A 83 -17.211 -1.104 -5.927 1.00 0.00 H new ATOM 0 HA ASP A 83 -16.600 -3.975 -5.492 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -17.873 -2.517 -3.739 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -19.228 -2.698 -4.836 1.00 0.00 H new ATOM 1179 N GLY A 84 -18.028 -4.834 -7.347 1.00 0.00 N ATOM 1180 CA GLY A 84 -18.580 -5.344 -8.589 1.00 0.00 C ATOM 1181 C GLY A 84 -20.060 -5.677 -8.465 1.00 0.00 C ATOM 1182 O GLY A 84 -20.765 -5.682 -9.479 1.00 0.00 O ATOM 0 H GLY A 84 -17.668 -5.563 -6.731 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -18.440 -4.605 -9.378 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -18.032 -6.237 -8.889 1.00 0.00 H new ATOM 1186 N GLU A 85 -20.559 -5.909 -7.248 1.00 0.00 N ATOM 1187 CA GLU A 85 -21.902 -6.419 -7.049 1.00 0.00 C ATOM 1188 C GLU A 85 -22.910 -5.347 -7.450 1.00 0.00 C ATOM 1189 O GLU A 85 -22.655 -4.146 -7.343 1.00 0.00 O ATOM 1190 CB GLU A 85 -22.119 -6.837 -5.588 1.00 0.00 C ATOM 1191 CG GLU A 85 -21.200 -7.976 -5.117 1.00 0.00 C ATOM 1192 CD GLU A 85 -21.338 -9.274 -5.912 1.00 0.00 C ATOM 1193 OE1 GLU A 85 -22.483 -9.632 -6.272 1.00 0.00 O ATOM 1194 OE2 GLU A 85 -20.328 -10.001 -6.058 1.00 0.00 O ATOM 0 H GLU A 85 -20.041 -5.747 -6.384 1.00 0.00 H new ATOM 0 HA GLU A 85 -22.042 -7.302 -7.672 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -21.963 -5.970 -4.946 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -23.157 -7.145 -5.460 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -20.165 -7.638 -5.175 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -21.409 -8.184 -4.068 1.00 0.00 H new ATOM 1201 N ASP A 86 -24.076 -5.792 -7.904 1.00 0.00 N ATOM 1202 CA ASP A 86 -25.132 -4.935 -8.458 1.00 0.00 C ATOM 1203 C ASP A 86 -26.465 -5.177 -7.730 1.00 0.00 C ATOM 1204 O ASP A 86 -27.523 -4.713 -8.154 1.00 0.00 O ATOM 1205 CB ASP A 86 -25.212 -5.158 -9.979 1.00 0.00 C ATOM 1206 CG ASP A 86 -25.427 -3.860 -10.755 1.00 0.00 C ATOM 1207 OD1 ASP A 86 -24.486 -3.028 -10.758 1.00 0.00 O ATOM 1208 OD2 ASP A 86 -26.438 -3.775 -11.489 1.00 0.00 O ATOM 0 H ASP A 86 -24.325 -6.781 -7.900 1.00 0.00 H new ATOM 0 HA ASP A 86 -24.895 -3.884 -8.295 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -24.293 -5.633 -10.321 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -26.028 -5.847 -10.199 1.00 0.00 H new ATOM 1213 N GLY A 87 -26.420 -5.922 -6.619 1.00 0.00 N ATOM 1214 CA GLY A 87 -27.547 -6.330 -5.781 1.00 0.00 C ATOM 1215 C GLY A 87 -27.240 -6.193 -4.286 1.00 0.00 C ATOM 1216 O GLY A 87 -27.896 -6.834 -3.458 1.00 0.00 O ATOM 0 H GLY A 87 -25.534 -6.278 -6.260 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -28.418 -5.724 -6.028 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -27.806 -7.365 -6.003 1.00 0.00 H new ATOM 1220 N VAL A 88 -26.226 -5.396 -3.932 1.00 0.00 N ATOM 1221 CA VAL A 88 -25.801 -5.128 -2.562 1.00 0.00 C ATOM 1222 C VAL A 88 -25.599 -3.611 -2.452 1.00 0.00 C ATOM 1223 O VAL A 88 -25.059 -2.989 -3.376 1.00 0.00 O ATOM 1224 CB VAL A 88 -24.527 -5.934 -2.212 1.00 0.00 C ATOM 1225 CG1 VAL A 88 -24.275 -5.921 -0.697 1.00 0.00 C ATOM 1226 CG2 VAL A 88 -24.602 -7.413 -2.636 1.00 0.00 C ATOM 0 H VAL A 88 -25.660 -4.903 -4.622 1.00 0.00 H new ATOM 0 HA VAL A 88 -26.550 -5.449 -1.838 1.00 0.00 H new ATOM 0 HB VAL A 88 -23.723 -5.445 -2.763 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -23.375 -6.493 -0.473 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -24.145 -4.893 -0.359 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -25.126 -6.367 -0.183 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -23.676 -7.918 -2.360 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -25.441 -7.894 -2.133 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -24.742 -7.475 -3.715 1.00 0.00 H new ATOM 1236 N VAL A 89 -26.058 -3.008 -1.357 1.00 0.00 N ATOM 1237 CA VAL A 89 -25.850 -1.609 -1.000 1.00 0.00 C ATOM 1238 C VAL A 89 -25.467 -1.587 0.480 1.00 0.00 C ATOM 1239 O VAL A 89 -25.906 -2.455 1.242 1.00 0.00 O ATOM 1240 CB VAL A 89 -27.112 -0.789 -1.347 1.00 0.00 C ATOM 1241 CG1 VAL A 89 -28.367 -1.219 -0.569 1.00 0.00 C ATOM 1242 CG2 VAL A 89 -26.882 0.717 -1.156 1.00 0.00 C ATOM 0 H VAL A 89 -26.612 -3.508 -0.662 1.00 0.00 H new ATOM 0 HA VAL A 89 -25.045 -1.140 -1.566 1.00 0.00 H new ATOM 0 HB VAL A 89 -27.298 -0.999 -2.400 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -29.211 -0.597 -0.867 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -28.591 -2.263 -0.788 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -28.190 -1.102 0.500 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -27.793 1.259 -1.410 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -26.619 0.916 -0.117 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -26.071 1.046 -1.805 1.00 0.00 H new ATOM 1252 N ASN A 90 -24.633 -0.636 0.900 1.00 0.00 N ATOM 1253 CA ASN A 90 -23.929 -0.690 2.179 1.00 0.00 C ATOM 1254 C ASN A 90 -23.695 0.730 2.690 1.00 0.00 C ATOM 1255 O ASN A 90 -24.242 1.694 2.153 1.00 0.00 O ATOM 1256 CB ASN A 90 -22.581 -1.407 1.995 1.00 0.00 C ATOM 1257 CG ASN A 90 -22.700 -2.843 1.522 1.00 0.00 C ATOM 1258 OD1 ASN A 90 -22.692 -3.091 0.321 1.00 0.00 O ATOM 1259 ND2 ASN A 90 -22.802 -3.801 2.426 1.00 0.00 N ATOM 0 H ASN A 90 -24.426 0.201 0.356 1.00 0.00 H new ATOM 0 HA ASN A 90 -24.530 -1.239 2.904 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -21.980 -0.848 1.277 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -22.042 -1.392 2.942 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -22.877 -4.775 2.131 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -22.806 -3.567 3.419 1.00 0.00 H new ATOM 1266 N GLU A 91 -22.869 0.862 3.725 1.00 0.00 N ATOM 1267 CA GLU A 91 -22.179 2.097 4.055 1.00 0.00 C ATOM 1268 C GLU A 91 -20.840 2.193 3.308 1.00 0.00 C ATOM 1269 O GLU A 91 -20.383 1.195 2.742 1.00 0.00 O ATOM 1270 CB GLU A 91 -21.998 2.171 5.581 1.00 0.00 C ATOM 1271 CG GLU A 91 -23.192 2.932 6.154 1.00 0.00 C ATOM 1272 CD GLU A 91 -22.918 3.463 7.545 1.00 0.00 C ATOM 1273 OE1 GLU A 91 -22.446 4.616 7.653 1.00 0.00 O ATOM 1274 OE2 GLU A 91 -23.239 2.761 8.532 1.00 0.00 O ATOM 0 H GLU A 91 -22.660 0.097 4.367 1.00 0.00 H new ATOM 0 HA GLU A 91 -22.774 2.952 3.733 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -21.942 1.170 6.008 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -21.066 2.677 5.831 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -23.443 3.762 5.493 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -24.060 2.274 6.183 1.00 0.00 H new ATOM 1281 N PRO A 92 -20.216 3.384 3.268 1.00 0.00 N ATOM 1282 CA PRO A 92 -18.945 3.603 2.587 1.00 0.00 C ATOM 1283 C PRO A 92 -17.740 3.106 3.403 1.00 0.00 C ATOM 1284 O PRO A 92 -17.870 2.763 4.583 1.00 0.00 O ATOM 1285 CB PRO A 92 -18.910 5.119 2.398 1.00 0.00 C ATOM 1286 CG PRO A 92 -19.586 5.652 3.655 1.00 0.00 C ATOM 1287 CD PRO A 92 -20.722 4.648 3.806 1.00 0.00 C ATOM 0 HA PRO A 92 -18.875 3.048 1.652 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -17.889 5.488 2.305 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -19.442 5.423 1.497 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -18.918 5.654 4.516 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -19.948 6.672 3.530 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -21.011 4.540 4.851 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -21.608 4.977 3.263 1.00 0.00 H new ATOM 1295 N MET A 93 -16.535 3.138 2.814 1.00 0.00 N ATOM 1296 CA MET A 93 -15.293 2.771 3.500 1.00 0.00 C ATOM 1297 C MET A 93 -14.256 3.892 3.420 1.00 0.00 C ATOM 1298 O MET A 93 -14.343 4.771 2.561 1.00 0.00 O ATOM 1299 CB MET A 93 -14.739 1.431 2.990 1.00 0.00 C ATOM 1300 CG MET A 93 -13.997 1.519 1.643 1.00 0.00 C ATOM 1301 SD MET A 93 -13.072 0.065 1.061 1.00 0.00 S ATOM 1302 CE MET A 93 -12.685 -0.786 2.606 1.00 0.00 C ATOM 0 H MET A 93 -16.397 3.421 1.844 1.00 0.00 H new ATOM 0 HA MET A 93 -15.530 2.633 4.555 1.00 0.00 H new ATOM 0 HB2 MET A 93 -14.060 1.024 3.739 1.00 0.00 H new ATOM 0 HB3 MET A 93 -15.564 0.725 2.891 1.00 0.00 H new ATOM 0 HG2 MET A 93 -14.730 1.773 0.877 1.00 0.00 H new ATOM 0 HG3 MET A 93 -13.298 2.353 1.704 1.00 0.00 H new ATOM 0 HE1 MET A 93 -12.136 -1.702 2.389 1.00 0.00 H new ATOM 0 HE2 MET A 93 -12.076 -0.138 3.236 1.00 0.00 H new ATOM 0 HE3 MET A 93 -13.610 -1.033 3.127 1.00 0.00 H new ATOM 1312 N GLN A 94 -13.246 3.842 4.292 1.00 0.00 N ATOM 1313 CA GLN A 94 -12.168 4.823 4.382 1.00 0.00 C ATOM 1314 C GLN A 94 -10.875 4.080 4.709 1.00 0.00 C ATOM 1315 O GLN A 94 -10.911 3.088 5.437 1.00 0.00 O ATOM 1316 CB GLN A 94 -12.508 5.868 5.463 1.00 0.00 C ATOM 1317 CG GLN A 94 -13.620 6.808 4.971 1.00 0.00 C ATOM 1318 CD GLN A 94 -14.120 7.826 5.990 1.00 0.00 C ATOM 1319 OE1 GLN A 94 -13.675 7.896 7.135 1.00 0.00 O ATOM 1320 NE2 GLN A 94 -15.118 8.596 5.598 1.00 0.00 N ATOM 0 H GLN A 94 -13.156 3.091 4.977 1.00 0.00 H new ATOM 0 HA GLN A 94 -12.044 5.354 3.438 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -12.826 5.365 6.376 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -11.618 6.446 5.711 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -13.256 7.346 4.096 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -14.465 6.202 4.644 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -15.474 8.524 4.645 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -15.533 9.263 6.248 1.00 0.00 H new ATOM 1329 N TRP A 95 -9.737 4.529 4.178 1.00 0.00 N ATOM 1330 CA TRP A 95 -8.422 3.939 4.448 1.00 0.00 C ATOM 1331 C TRP A 95 -7.513 5.032 4.995 1.00 0.00 C ATOM 1332 O TRP A 95 -7.711 6.210 4.692 1.00 0.00 O ATOM 1333 CB TRP A 95 -7.790 3.333 3.178 1.00 0.00 C ATOM 1334 CG TRP A 95 -8.482 2.203 2.470 1.00 0.00 C ATOM 1335 CD1 TRP A 95 -9.523 1.485 2.944 1.00 0.00 C ATOM 1336 CD2 TRP A 95 -8.192 1.632 1.152 1.00 0.00 C ATOM 1337 NE1 TRP A 95 -9.913 0.554 2.010 1.00 0.00 N ATOM 1338 CE2 TRP A 95 -9.160 0.626 0.872 1.00 0.00 C ATOM 1339 CE3 TRP A 95 -7.232 1.868 0.144 1.00 0.00 C ATOM 1340 CZ2 TRP A 95 -9.219 -0.064 -0.342 1.00 0.00 C ATOM 1341 CZ3 TRP A 95 -7.305 1.211 -1.099 1.00 0.00 C ATOM 1342 CH2 TRP A 95 -8.306 0.260 -1.352 1.00 0.00 C ATOM 0 H TRP A 95 -9.701 5.323 3.539 1.00 0.00 H new ATOM 0 HA TRP A 95 -8.544 3.131 5.169 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -7.666 4.142 2.458 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -6.791 2.988 3.444 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -9.981 1.622 3.912 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -10.674 -0.111 2.150 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -6.428 2.565 0.330 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 -9.958 -0.836 -0.498 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -6.582 1.442 -1.867 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -8.371 -0.218 -2.318 1.00 0.00 H new ATOM 1353 N VAL A 96 -6.468 4.653 5.729 1.00 0.00 N ATOM 1354 CA VAL A 96 -5.477 5.590 6.260 1.00 0.00 C ATOM 1355 C VAL A 96 -4.104 4.996 5.956 1.00 0.00 C ATOM 1356 O VAL A 96 -3.794 3.876 6.369 1.00 0.00 O ATOM 1357 CB VAL A 96 -5.704 5.893 7.761 1.00 0.00 C ATOM 1358 CG1 VAL A 96 -4.952 7.170 8.166 1.00 0.00 C ATOM 1359 CG2 VAL A 96 -7.185 6.082 8.130 1.00 0.00 C ATOM 0 H VAL A 96 -6.283 3.680 5.974 1.00 0.00 H new ATOM 0 HA VAL A 96 -5.566 6.566 5.783 1.00 0.00 H new ATOM 0 HB VAL A 96 -5.328 5.021 8.297 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -5.120 7.371 9.224 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -3.885 7.036 7.987 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -5.316 8.010 7.574 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -7.270 6.291 9.196 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -7.598 6.916 7.562 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -7.738 5.173 7.893 1.00 0.00 H new ATOM 1369 N VAL A 97 -3.298 5.694 5.163 1.00 0.00 N ATOM 1370 CA VAL A 97 -2.111 5.157 4.532 1.00 0.00 C ATOM 1371 C VAL A 97 -0.957 6.113 4.857 1.00 0.00 C ATOM 1372 O VAL A 97 -1.040 7.317 4.603 1.00 0.00 O ATOM 1373 CB VAL A 97 -2.413 4.940 3.031 1.00 0.00 C ATOM 1374 CG1 VAL A 97 -3.352 3.748 2.808 1.00 0.00 C ATOM 1375 CG2 VAL A 97 -3.038 6.132 2.291 1.00 0.00 C ATOM 0 H VAL A 97 -3.462 6.675 4.939 1.00 0.00 H new ATOM 0 HA VAL A 97 -1.810 4.177 4.902 1.00 0.00 H new ATOM 0 HB VAL A 97 -1.419 4.772 2.617 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -3.540 3.628 1.741 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -2.889 2.842 3.199 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -4.295 3.926 3.325 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -3.205 5.865 1.247 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -3.989 6.391 2.756 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -2.364 6.987 2.343 1.00 0.00 H new ATOM 1385 N THR A 98 0.121 5.608 5.456 1.00 0.00 N ATOM 1386 CA THR A 98 1.223 6.429 5.942 1.00 0.00 C ATOM 1387 C THR A 98 2.477 5.933 5.226 1.00 0.00 C ATOM 1388 O THR A 98 2.515 4.806 4.710 1.00 0.00 O ATOM 1389 CB THR A 98 1.281 6.364 7.487 1.00 0.00 C ATOM 1390 OG1 THR A 98 0.057 6.809 8.056 1.00 0.00 O ATOM 1391 CG2 THR A 98 2.377 7.223 8.125 1.00 0.00 C ATOM 0 H THR A 98 0.252 4.609 5.618 1.00 0.00 H new ATOM 0 HA THR A 98 1.106 7.489 5.718 1.00 0.00 H new ATOM 0 HB THR A 98 1.491 5.315 7.695 1.00 0.00 H new ATOM 0 HG1 THR A 98 0.113 6.759 9.033 1.00 0.00 H new ATOM 0 HG21 THR A 98 2.340 7.114 9.209 1.00 0.00 H new ATOM 0 HG22 THR A 98 3.352 6.899 7.760 1.00 0.00 H new ATOM 0 HG23 THR A 98 2.220 8.269 7.860 1.00 0.00 H new ATOM 1399 N VAL A 99 3.482 6.799 5.140 1.00 0.00 N ATOM 1400 CA VAL A 99 4.761 6.497 4.510 1.00 0.00 C ATOM 1401 C VAL A 99 5.883 6.927 5.440 1.00 0.00 C ATOM 1402 O VAL A 99 5.912 8.067 5.914 1.00 0.00 O ATOM 1403 CB VAL A 99 4.873 7.192 3.138 1.00 0.00 C ATOM 1404 CG1 VAL A 99 6.114 6.776 2.345 1.00 0.00 C ATOM 1405 CG2 VAL A 99 3.648 6.961 2.236 1.00 0.00 C ATOM 0 H VAL A 99 3.429 7.747 5.513 1.00 0.00 H new ATOM 0 HA VAL A 99 4.837 5.424 4.334 1.00 0.00 H new ATOM 0 HB VAL A 99 4.943 8.248 3.398 1.00 0.00 H new ATOM 0 HG11 VAL A 99 6.130 7.303 1.391 1.00 0.00 H new ATOM 0 HG12 VAL A 99 7.010 7.027 2.913 1.00 0.00 H new ATOM 0 HG13 VAL A 99 6.088 5.701 2.166 1.00 0.00 H new ATOM 0 HG21 VAL A 99 3.792 7.477 1.287 1.00 0.00 H new ATOM 0 HG22 VAL A 99 3.527 5.893 2.053 1.00 0.00 H new ATOM 0 HG23 VAL A 99 2.756 7.349 2.728 1.00 0.00 H new ATOM 1415 N TYR A 100 6.834 6.023 5.637 1.00 0.00 N ATOM 1416 CA TYR A 100 8.093 6.240 6.322 1.00 0.00 C ATOM 1417 C TYR A 100 9.242 6.086 5.320 1.00 0.00 C ATOM 1418 O TYR A 100 9.050 5.586 4.213 1.00 0.00 O ATOM 1419 CB TYR A 100 8.212 5.251 7.490 1.00 0.00 C ATOM 1420 CG TYR A 100 7.138 5.394 8.551 1.00 0.00 C ATOM 1421 CD1 TYR A 100 5.868 4.817 8.359 1.00 0.00 C ATOM 1422 CD2 TYR A 100 7.410 6.112 9.730 1.00 0.00 C ATOM 1423 CE1 TYR A 100 4.857 4.998 9.320 1.00 0.00 C ATOM 1424 CE2 TYR A 100 6.404 6.302 10.692 1.00 0.00 C ATOM 1425 CZ TYR A 100 5.116 5.760 10.481 1.00 0.00 C ATOM 1426 OH TYR A 100 4.128 5.944 11.394 1.00 0.00 O ATOM 0 H TYR A 100 6.737 5.064 5.302 1.00 0.00 H new ATOM 0 HA TYR A 100 8.139 7.248 6.734 1.00 0.00 H new ATOM 0 HB2 TYR A 100 8.180 4.236 7.094 1.00 0.00 H new ATOM 0 HB3 TYR A 100 9.187 5.379 7.959 1.00 0.00 H new ATOM 0 HD1 TYR A 100 5.670 4.234 7.472 1.00 0.00 H new ATOM 0 HD2 TYR A 100 8.397 6.519 9.896 1.00 0.00 H new ATOM 0 HE1 TYR A 100 3.884 4.555 9.170 1.00 0.00 H new ATOM 0 HE2 TYR A 100 6.615 6.861 11.591 1.00 0.00 H new ATOM 0 HH TYR A 100 4.465 6.489 12.135 1.00 0.00 H new ATOM 1436 N LYS A 101 10.446 6.515 5.685 1.00 0.00 N ATOM 1437 CA LYS A 101 11.662 6.448 4.892 1.00 0.00 C ATOM 1438 C LYS A 101 12.723 5.720 5.712 1.00 0.00 C ATOM 1439 O LYS A 101 12.385 4.954 6.613 1.00 0.00 O ATOM 1440 CB LYS A 101 12.043 7.887 4.476 1.00 0.00 C ATOM 1441 CG LYS A 101 12.665 7.937 3.074 1.00 0.00 C ATOM 1442 CD LYS A 101 14.115 8.423 2.991 1.00 0.00 C ATOM 1443 CE LYS A 101 14.445 9.244 1.735 1.00 0.00 C ATOM 1444 NZ LYS A 101 13.915 8.709 0.457 1.00 0.00 N ATOM 0 H LYS A 101 10.605 6.944 6.597 1.00 0.00 H new ATOM 0 HA LYS A 101 11.543 5.881 3.969 1.00 0.00 H new ATOM 0 HB2 LYS A 101 11.155 8.518 4.501 1.00 0.00 H new ATOM 0 HB3 LYS A 101 12.747 8.299 5.199 1.00 0.00 H new ATOM 0 HG2 LYS A 101 12.614 6.938 2.641 1.00 0.00 H new ATOM 0 HG3 LYS A 101 12.051 8.586 2.450 1.00 0.00 H new ATOM 0 HD2 LYS A 101 14.332 9.028 3.871 1.00 0.00 H new ATOM 0 HD3 LYS A 101 14.777 7.558 3.027 1.00 0.00 H new ATOM 0 HE2 LYS A 101 14.059 10.254 1.872 1.00 0.00 H new ATOM 0 HE3 LYS A 101 15.529 9.326 1.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 14.652 8.764 -0.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 13.630 7.717 0.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 13.091 9.270 0.161 1.00 0.00 H new ATOM 1458 N ASN A 102 14.005 5.951 5.431 1.00 0.00 N ATOM 1459 CA ASN A 102 15.122 5.600 6.306 1.00 0.00 C ATOM 1460 C ASN A 102 15.106 6.405 7.620 1.00 0.00 C ATOM 1461 O ASN A 102 15.997 7.212 7.890 1.00 0.00 O ATOM 1462 CB ASN A 102 16.471 5.687 5.562 1.00 0.00 C ATOM 1463 CG ASN A 102 16.791 7.018 4.875 1.00 0.00 C ATOM 1464 OD1 ASN A 102 16.444 8.104 5.313 1.00 0.00 O ATOM 1465 ND2 ASN A 102 17.463 6.959 3.741 1.00 0.00 N ATOM 0 H ASN A 102 14.303 6.400 4.565 1.00 0.00 H new ATOM 0 HA ASN A 102 14.995 4.557 6.597 1.00 0.00 H new ATOM 0 HB2 ASN A 102 17.267 5.471 6.274 1.00 0.00 H new ATOM 0 HB3 ASN A 102 16.496 4.900 4.808 1.00 0.00 H new ATOM 0 HD21 ASN A 102 17.689 7.816 3.237 1.00 0.00 H new ATOM 0 HD22 ASN A 102 17.756 6.056 3.368 1.00 0.00 H new ATOM 1472 N GLY A 103 14.125 6.140 8.481 1.00 0.00 N ATOM 1473 CA GLY A 103 14.099 6.573 9.871 1.00 0.00 C ATOM 1474 C GLY A 103 13.308 7.857 10.091 1.00 0.00 C ATOM 1475 O GLY A 103 13.732 8.686 10.896 1.00 0.00 O ATOM 0 H GLY A 103 13.301 5.600 8.218 1.00 0.00 H new ATOM 0 HA2 GLY A 103 13.668 5.780 10.483 1.00 0.00 H new ATOM 0 HA3 GLY A 103 15.122 6.722 10.217 1.00 0.00 H new ATOM 1479 N LYS A 104 12.186 8.045 9.388 1.00 0.00 N ATOM 1480 CA LYS A 104 11.216 9.104 9.664 1.00 0.00 C ATOM 1481 C LYS A 104 9.904 8.804 8.946 1.00 0.00 C ATOM 1482 O LYS A 104 9.937 8.204 7.874 1.00 0.00 O ATOM 1483 CB LYS A 104 11.754 10.481 9.199 1.00 0.00 C ATOM 1484 CG LYS A 104 12.010 11.441 10.372 1.00 0.00 C ATOM 1485 CD LYS A 104 10.713 11.803 11.105 1.00 0.00 C ATOM 1486 CE LYS A 104 9.946 12.960 10.460 1.00 0.00 C ATOM 1487 NZ LYS A 104 10.435 14.271 10.926 1.00 0.00 N ATOM 0 H LYS A 104 11.924 7.454 8.599 1.00 0.00 H new ATOM 0 HA LYS A 104 11.047 9.140 10.740 1.00 0.00 H new ATOM 0 HB2 LYS A 104 12.681 10.336 8.644 1.00 0.00 H new ATOM 0 HB3 LYS A 104 11.038 10.934 8.513 1.00 0.00 H new ATOM 0 HG2 LYS A 104 12.707 10.981 11.072 1.00 0.00 H new ATOM 0 HG3 LYS A 104 12.484 12.350 10.001 1.00 0.00 H new ATOM 0 HD2 LYS A 104 10.068 10.925 11.139 1.00 0.00 H new ATOM 0 HD3 LYS A 104 10.950 12.065 12.136 1.00 0.00 H new ATOM 0 HE2 LYS A 104 10.043 12.901 9.376 1.00 0.00 H new ATOM 0 HE3 LYS A 104 8.885 12.865 10.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 9.890 15.028 10.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 10.319 14.338 11.957 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 11.441 14.372 10.684 1.00 0.00 H new ATOM 1501 N GLU A 105 8.778 9.291 9.475 1.00 0.00 N ATOM 1502 CA GLU A 105 7.545 9.507 8.714 1.00 0.00 C ATOM 1503 C GLU A 105 7.865 10.584 7.674 1.00 0.00 C ATOM 1504 O GLU A 105 8.515 11.576 8.016 1.00 0.00 O ATOM 1505 CB GLU A 105 6.424 10.006 9.653 1.00 0.00 C ATOM 1506 CG GLU A 105 5.055 10.223 8.968 1.00 0.00 C ATOM 1507 CD GLU A 105 4.100 11.100 9.798 1.00 0.00 C ATOM 1508 OE1 GLU A 105 4.481 12.248 10.145 1.00 0.00 O ATOM 1509 OE2 GLU A 105 2.948 10.688 10.082 1.00 0.00 O ATOM 0 H GLU A 105 8.697 9.550 10.458 1.00 0.00 H new ATOM 0 HA GLU A 105 7.204 8.585 8.244 1.00 0.00 H new ATOM 0 HB2 GLU A 105 6.300 9.286 10.462 1.00 0.00 H new ATOM 0 HB3 GLU A 105 6.740 10.945 10.107 1.00 0.00 H new ATOM 0 HG2 GLU A 105 5.212 10.687 7.994 1.00 0.00 H new ATOM 0 HG3 GLU A 105 4.587 9.255 8.788 1.00 0.00 H new ATOM 1516 N ILE A 106 7.395 10.420 6.438 1.00 0.00 N ATOM 1517 CA ILE A 106 7.485 11.432 5.395 1.00 0.00 C ATOM 1518 C ILE A 106 6.115 11.788 4.815 1.00 0.00 C ATOM 1519 O ILE A 106 5.954 12.936 4.394 1.00 0.00 O ATOM 1520 CB ILE A 106 8.481 11.009 4.295 1.00 0.00 C ATOM 1521 CG1 ILE A 106 8.164 9.608 3.721 1.00 0.00 C ATOM 1522 CG2 ILE A 106 9.921 11.082 4.835 1.00 0.00 C ATOM 1523 CD1 ILE A 106 8.844 9.358 2.374 1.00 0.00 C ATOM 0 H ILE A 106 6.933 9.564 6.132 1.00 0.00 H new ATOM 0 HA ILE A 106 7.870 12.340 5.858 1.00 0.00 H new ATOM 0 HB ILE A 106 8.379 11.709 3.465 1.00 0.00 H new ATOM 0 HG12 ILE A 106 8.484 8.847 4.432 1.00 0.00 H new ATOM 0 HG13 ILE A 106 7.085 9.502 3.605 1.00 0.00 H new ATOM 0 HG21 ILE A 106 10.618 10.782 4.053 1.00 0.00 H new ATOM 0 HG22 ILE A 106 10.142 12.103 5.146 1.00 0.00 H new ATOM 0 HG23 ILE A 106 10.024 10.413 5.689 1.00 0.00 H new ATOM 0 HD11 ILE A 106 8.588 8.361 2.017 1.00 0.00 H new ATOM 0 HD12 ILE A 106 8.505 10.100 1.652 1.00 0.00 H new ATOM 0 HD13 ILE A 106 9.925 9.435 2.492 1.00 0.00 H new ATOM 1535 N GLU A 107 5.124 10.888 4.818 1.00 0.00 N ATOM 1536 CA GLU A 107 3.809 11.143 4.220 1.00 0.00 C ATOM 1537 C GLU A 107 2.725 10.555 5.113 1.00 0.00 C ATOM 1538 O GLU A 107 2.942 9.544 5.782 1.00 0.00 O ATOM 1539 CB GLU A 107 3.697 10.530 2.810 1.00 0.00 C ATOM 1540 CG GLU A 107 2.687 11.217 1.884 1.00 0.00 C ATOM 1541 CD GLU A 107 3.357 12.364 1.137 1.00 0.00 C ATOM 1542 OE1 GLU A 107 3.965 12.100 0.071 1.00 0.00 O ATOM 1543 OE2 GLU A 107 3.330 13.504 1.651 1.00 0.00 O ATOM 0 H GLU A 107 5.212 9.962 5.236 1.00 0.00 H new ATOM 0 HA GLU A 107 3.683 12.222 4.130 1.00 0.00 H new ATOM 0 HB2 GLU A 107 4.679 10.560 2.338 1.00 0.00 H new ATOM 0 HB3 GLU A 107 3.422 9.480 2.907 1.00 0.00 H new ATOM 0 HG2 GLU A 107 2.285 10.496 1.173 1.00 0.00 H new ATOM 0 HG3 GLU A 107 1.846 11.594 2.466 1.00 0.00 H new ATOM 1550 N LYS A 108 1.551 11.175 5.095 1.00 0.00 N ATOM 1551 CA LYS A 108 0.403 10.879 5.929 1.00 0.00 C ATOM 1552 C LYS A 108 -0.815 11.318 5.128 1.00 0.00 C ATOM 1553 O LYS A 108 -0.974 12.515 4.862 1.00 0.00 O ATOM 1554 CB LYS A 108 0.542 11.622 7.274 1.00 0.00 C ATOM 1555 CG LYS A 108 0.860 13.131 7.152 1.00 0.00 C ATOM 1556 CD LYS A 108 1.295 13.768 8.465 1.00 0.00 C ATOM 1557 CE LYS A 108 0.167 13.716 9.495 1.00 0.00 C ATOM 1558 NZ LYS A 108 0.369 14.740 10.533 1.00 0.00 N ATOM 0 H LYS A 108 1.369 11.947 4.454 1.00 0.00 H new ATOM 0 HA LYS A 108 0.314 9.822 6.178 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -0.385 11.505 7.835 1.00 0.00 H new ATOM 0 HB3 LYS A 108 1.330 11.145 7.857 1.00 0.00 H new ATOM 0 HG2 LYS A 108 1.648 13.270 6.412 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -0.022 13.651 6.780 1.00 0.00 H new ATOM 0 HD2 LYS A 108 2.172 13.249 8.853 1.00 0.00 H new ATOM 0 HD3 LYS A 108 1.588 14.804 8.292 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -0.792 13.874 9.001 1.00 0.00 H new ATOM 0 HE3 LYS A 108 0.130 12.728 9.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -0.406 14.691 11.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 1.275 14.571 11.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 0.381 15.682 10.093 1.00 0.00 H new ATOM 1572 N LYS A 109 -1.617 10.380 4.627 1.00 0.00 N ATOM 1573 CA LYS A 109 -2.908 10.760 4.040 1.00 0.00 C ATOM 1574 C LYS A 109 -3.962 9.676 4.219 1.00 0.00 C ATOM 1575 O LYS A 109 -3.652 8.487 4.264 1.00 0.00 O ATOM 1576 CB LYS A 109 -2.751 11.171 2.562 1.00 0.00 C ATOM 1577 CG LYS A 109 -2.092 10.100 1.673 1.00 0.00 C ATOM 1578 CD LYS A 109 -2.882 9.744 0.407 1.00 0.00 C ATOM 1579 CE LYS A 109 -2.689 10.703 -0.780 1.00 0.00 C ATOM 1580 NZ LYS A 109 -3.406 11.985 -0.632 1.00 0.00 N ATOM 0 H LYS A 109 -1.409 9.382 4.613 1.00 0.00 H new ATOM 0 HA LYS A 109 -3.266 11.633 4.586 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -3.735 11.408 2.157 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -2.157 12.084 2.512 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -1.102 10.449 1.381 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -1.950 9.195 2.263 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -2.598 8.740 0.092 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -3.942 9.711 0.658 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -1.625 10.905 -0.903 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -3.028 10.211 -1.692 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -3.230 12.579 -1.467 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -4.426 11.804 -0.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -3.067 12.476 0.220 1.00 0.00 H new ATOM 1594 N SER A 110 -5.226 10.079 4.227 1.00 0.00 N ATOM 1595 CA SER A 110 -6.375 9.228 4.383 1.00 0.00 C ATOM 1596 C SER A 110 -7.267 9.351 3.144 1.00 0.00 C ATOM 1597 O SER A 110 -7.179 10.325 2.382 1.00 0.00 O ATOM 1598 CB SER A 110 -7.071 9.625 5.690 1.00 0.00 C ATOM 1599 OG SER A 110 -6.250 10.386 6.576 1.00 0.00 O ATOM 0 H SER A 110 -5.479 11.061 4.118 1.00 0.00 H new ATOM 0 HA SER A 110 -6.106 8.174 4.456 1.00 0.00 H new ATOM 0 HB2 SER A 110 -7.965 10.202 5.453 1.00 0.00 H new ATOM 0 HB3 SER A 110 -7.402 8.722 6.203 1.00 0.00 H new ATOM 0 HG SER A 110 -6.757 10.605 7.385 1.00 0.00 H new ATOM 1605 N LEU A 111 -8.100 8.341 2.903 1.00 0.00 N ATOM 1606 CA LEU A 111 -8.765 8.109 1.630 1.00 0.00 C ATOM 1607 C LEU A 111 -10.245 7.909 1.898 1.00 0.00 C ATOM 1608 O LEU A 111 -10.610 7.347 2.936 1.00 0.00 O ATOM 1609 CB LEU A 111 -8.193 6.859 0.933 1.00 0.00 C ATOM 1610 CG LEU A 111 -6.670 6.855 0.698 1.00 0.00 C ATOM 1611 CD1 LEU A 111 -6.259 5.544 0.025 1.00 0.00 C ATOM 1612 CD2 LEU A 111 -6.206 8.032 -0.161 1.00 0.00 C ATOM 0 H LEU A 111 -8.335 7.644 3.610 1.00 0.00 H new ATOM 0 HA LEU A 111 -8.604 8.965 0.975 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -8.451 5.984 1.530 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -8.690 6.745 -0.031 1.00 0.00 H new ATOM 0 HG LEU A 111 -6.192 6.952 1.673 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -5.182 5.542 -0.141 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -6.529 4.705 0.667 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -6.773 5.449 -0.931 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -5.126 7.981 -0.295 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -6.695 7.987 -1.134 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -6.466 8.968 0.333 1.00 0.00 H new ATOM 1624 N VAL A 112 -11.091 8.328 0.962 1.00 0.00 N ATOM 1625 CA VAL A 112 -12.532 8.370 1.149 1.00 0.00 C ATOM 1626 C VAL A 112 -13.211 7.682 -0.032 1.00 0.00 C ATOM 1627 O VAL A 112 -13.318 8.236 -1.129 1.00 0.00 O ATOM 1628 CB VAL A 112 -12.981 9.814 1.464 1.00 0.00 C ATOM 1629 CG1 VAL A 112 -12.661 10.853 0.374 1.00 0.00 C ATOM 1630 CG2 VAL A 112 -14.466 9.834 1.841 1.00 0.00 C ATOM 0 H VAL A 112 -10.789 8.651 0.043 1.00 0.00 H new ATOM 0 HA VAL A 112 -12.852 7.801 2.022 1.00 0.00 H new ATOM 0 HB VAL A 112 -12.379 10.130 2.316 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -13.016 11.834 0.691 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -11.584 10.892 0.213 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -13.156 10.570 -0.555 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -14.772 10.857 2.061 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -15.058 9.449 1.010 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -14.627 9.210 2.720 1.00 0.00 H new ATOM 1640 N PHE A 113 -13.626 6.437 0.185 1.00 0.00 N ATOM 1641 CA PHE A 113 -14.512 5.741 -0.726 1.00 0.00 C ATOM 1642 C PHE A 113 -15.950 5.969 -0.271 1.00 0.00 C ATOM 1643 O PHE A 113 -16.227 6.682 0.701 1.00 0.00 O ATOM 1644 CB PHE A 113 -14.137 4.258 -0.796 1.00 0.00 C ATOM 1645 CG PHE A 113 -12.732 4.018 -1.304 1.00 0.00 C ATOM 1646 CD1 PHE A 113 -12.486 3.991 -2.690 1.00 0.00 C ATOM 1647 CD2 PHE A 113 -11.668 3.850 -0.398 1.00 0.00 C ATOM 1648 CE1 PHE A 113 -11.186 3.763 -3.168 1.00 0.00 C ATOM 1649 CE2 PHE A 113 -10.367 3.627 -0.876 1.00 0.00 C ATOM 1650 CZ PHE A 113 -10.132 3.561 -2.259 1.00 0.00 C ATOM 0 H PHE A 113 -13.354 5.887 1.000 1.00 0.00 H new ATOM 0 HA PHE A 113 -14.413 6.130 -1.739 1.00 0.00 H new ATOM 0 HB2 PHE A 113 -14.237 3.818 0.196 1.00 0.00 H new ATOM 0 HB3 PHE A 113 -14.844 3.742 -1.446 1.00 0.00 H new ATOM 0 HD1 PHE A 113 -13.298 4.146 -3.386 1.00 0.00 H new ATOM 0 HD2 PHE A 113 -11.853 3.893 0.665 1.00 0.00 H new ATOM 0 HE1 PHE A 113 -10.996 3.743 -4.231 1.00 0.00 H new ATOM 0 HE2 PHE A 113 -9.549 3.506 -0.182 1.00 0.00 H new ATOM 0 HZ PHE A 113 -9.138 3.354 -2.626 1.00 0.00 H new ATOM 1660 N ARG A 114 -16.862 5.386 -1.035 1.00 0.00 N ATOM 1661 CA ARG A 114 -18.294 5.606 -1.003 1.00 0.00 C ATOM 1662 C ARG A 114 -18.953 4.231 -1.039 1.00 0.00 C ATOM 1663 O ARG A 114 -18.292 3.230 -0.750 1.00 0.00 O ATOM 1664 CB ARG A 114 -18.698 6.507 -2.174 1.00 0.00 C ATOM 1665 CG ARG A 114 -17.883 7.808 -2.228 1.00 0.00 C ATOM 1666 CD ARG A 114 -18.461 8.780 -3.253 1.00 0.00 C ATOM 1667 NE ARG A 114 -18.164 8.352 -4.629 1.00 0.00 N ATOM 1668 CZ ARG A 114 -18.217 9.150 -5.701 1.00 0.00 C ATOM 1669 NH1 ARG A 114 -18.518 10.438 -5.571 1.00 0.00 N ATOM 1670 NH2 ARG A 114 -17.990 8.652 -6.909 1.00 0.00 N ATOM 0 H ARG A 114 -16.599 4.699 -1.742 1.00 0.00 H new ATOM 0 HA ARG A 114 -18.620 6.124 -0.101 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -18.567 5.962 -3.109 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -19.757 6.750 -2.092 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -17.875 8.276 -1.244 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -16.848 7.581 -2.482 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -19.540 8.853 -3.118 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -18.051 9.775 -3.084 1.00 0.00 H new ATOM 0 HE ARG A 114 -17.899 7.378 -4.776 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -18.711 10.826 -4.648 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -18.556 11.039 -6.395 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -17.775 7.661 -7.020 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -18.030 9.260 -7.727 1.00 0.00 H new ATOM 1684 N ASP A 115 -20.246 4.185 -1.337 1.00 0.00 N ATOM 1685 CA ASP A 115 -20.956 2.969 -1.733 1.00 0.00 C ATOM 1686 C ASP A 115 -20.133 2.239 -2.797 1.00 0.00 C ATOM 1687 O ASP A 115 -19.478 2.885 -3.622 1.00 0.00 O ATOM 1688 CB ASP A 115 -22.326 3.332 -2.326 1.00 0.00 C ATOM 1689 CG ASP A 115 -23.282 3.910 -1.288 1.00 0.00 C ATOM 1690 OD1 ASP A 115 -23.074 5.072 -0.864 1.00 0.00 O ATOM 1691 OD2 ASP A 115 -24.227 3.214 -0.869 1.00 0.00 O ATOM 0 H ASP A 115 -20.846 5.009 -1.310 1.00 0.00 H new ATOM 0 HA ASP A 115 -21.098 2.332 -0.860 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -22.189 4.055 -3.130 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -22.773 2.442 -2.770 1.00 0.00 H new ATOM 1696 N GLY A 116 -20.180 0.903 -2.819 1.00 0.00 N ATOM 1697 CA GLY A 116 -19.338 0.103 -3.681 1.00 0.00 C ATOM 1698 C GLY A 116 -19.465 0.464 -5.152 1.00 0.00 C ATOM 1699 O GLY A 116 -18.468 0.417 -5.877 1.00 0.00 O ATOM 0 H GLY A 116 -20.809 0.355 -2.233 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -18.299 0.222 -3.374 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -19.591 -0.949 -3.549 1.00 0.00 H new ATOM 1703 N LYS A 117 -20.663 0.859 -5.599 1.00 0.00 N ATOM 1704 CA LYS A 117 -20.961 1.007 -7.021 1.00 0.00 C ATOM 1705 C LYS A 117 -20.678 2.384 -7.635 1.00 0.00 C ATOM 1706 O LYS A 117 -21.201 2.763 -8.691 1.00 0.00 O ATOM 1707 CB LYS A 117 -22.377 0.472 -7.314 1.00 0.00 C ATOM 1708 CG LYS A 117 -22.246 -0.854 -8.061 1.00 0.00 C ATOM 1709 CD LYS A 117 -21.525 -0.668 -9.412 1.00 0.00 C ATOM 1710 CE LYS A 117 -20.930 -2.005 -9.893 1.00 0.00 C ATOM 1711 NZ LYS A 117 -21.886 -3.135 -9.809 1.00 0.00 N ATOM 0 H LYS A 117 -21.447 1.083 -4.986 1.00 0.00 H new ATOM 0 HA LYS A 117 -20.233 0.390 -7.548 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -22.929 0.331 -6.385 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -22.938 1.190 -7.912 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -21.695 -1.566 -7.447 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -23.236 -1.278 -8.230 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -22.225 -0.286 -10.155 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -20.733 0.074 -9.309 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -20.596 -1.896 -10.925 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -20.049 -2.238 -9.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -21.443 -3.994 -10.194 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -22.147 -3.296 -8.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -22.739 -2.909 -10.359 1.00 0.00 H new ATOM 1725 N GLU A 118 -19.849 3.142 -6.950 1.00 0.00 N ATOM 1726 CA GLU A 118 -19.665 4.575 -7.050 1.00 0.00 C ATOM 1727 C GLU A 118 -18.310 5.026 -6.463 1.00 0.00 C ATOM 1728 O GLU A 118 -18.184 5.378 -5.297 1.00 0.00 O ATOM 1729 CB GLU A 118 -20.936 5.238 -6.446 1.00 0.00 C ATOM 1730 CG GLU A 118 -20.675 6.635 -5.895 1.00 0.00 C ATOM 1731 CD GLU A 118 -21.857 7.592 -5.753 1.00 0.00 C ATOM 1732 OE1 GLU A 118 -22.499 7.898 -6.788 1.00 0.00 O ATOM 1733 OE2 GLU A 118 -22.013 8.217 -4.681 1.00 0.00 O ATOM 0 H GLU A 118 -19.232 2.736 -6.247 1.00 0.00 H new ATOM 0 HA GLU A 118 -19.583 4.910 -8.084 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -21.709 5.294 -7.213 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -21.325 4.605 -5.648 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -20.218 6.524 -4.912 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -19.936 7.113 -6.538 1.00 0.00 H new ATOM 1740 N ILE A 119 -17.257 5.113 -7.276 1.00 0.00 N ATOM 1741 CA ILE A 119 -15.936 5.551 -6.805 1.00 0.00 C ATOM 1742 C ILE A 119 -15.231 6.413 -7.848 1.00 0.00 C ATOM 1743 O ILE A 119 -15.557 6.351 -9.038 1.00 0.00 O ATOM 1744 CB ILE A 119 -15.084 4.343 -6.394 1.00 0.00 C ATOM 1745 CG1 ILE A 119 -14.771 3.488 -7.631 1.00 0.00 C ATOM 1746 CG2 ILE A 119 -15.723 3.488 -5.281 1.00 0.00 C ATOM 1747 CD1 ILE A 119 -13.324 3.674 -8.068 1.00 0.00 C ATOM 0 H ILE A 119 -17.290 4.885 -8.270 1.00 0.00 H new ATOM 0 HA ILE A 119 -16.078 6.175 -5.922 1.00 0.00 H new ATOM 0 HB ILE A 119 -14.159 4.734 -5.970 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -14.956 2.437 -7.408 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -15.440 3.763 -8.447 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -15.066 2.652 -5.042 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -15.870 4.100 -4.391 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -16.685 3.107 -5.622 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -13.127 3.058 -8.946 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -13.150 4.722 -8.313 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -12.658 3.375 -7.258 1.00 0.00 H new ATOM 1759 N SER A 120 -14.254 7.194 -7.388 1.00 0.00 N ATOM 1760 CA SER A 120 -13.491 8.142 -8.175 1.00 0.00 C ATOM 1761 C SER A 120 -12.447 8.872 -7.314 1.00 0.00 C ATOM 1762 O SER A 120 -12.693 9.999 -6.867 1.00 0.00 O ATOM 1763 CB SER A 120 -14.458 9.129 -8.828 1.00 0.00 C ATOM 1764 OG SER A 120 -15.359 9.732 -7.906 1.00 0.00 O ATOM 0 H SER A 120 -13.965 7.176 -6.410 1.00 0.00 H new ATOM 0 HA SER A 120 -12.941 7.608 -8.949 1.00 0.00 H new ATOM 0 HB2 SER A 120 -13.885 9.910 -9.328 1.00 0.00 H new ATOM 0 HB3 SER A 120 -15.030 8.610 -9.597 1.00 0.00 H new ATOM 0 HG SER A 120 -14.855 10.103 -7.152 1.00 0.00 H new ATOM 1770 N THR A 121 -11.278 8.273 -7.068 1.00 0.00 N ATOM 1771 CA THR A 121 -10.339 8.834 -6.095 1.00 0.00 C ATOM 1772 C THR A 121 -8.885 8.765 -6.523 1.00 0.00 C ATOM 1773 O THR A 121 -8.444 7.827 -7.182 1.00 0.00 O ATOM 1774 CB THR A 121 -10.550 8.174 -4.714 1.00 0.00 C ATOM 1775 OG1 THR A 121 -11.112 6.872 -4.784 1.00 0.00 O ATOM 1776 CG2 THR A 121 -11.465 9.045 -3.852 1.00 0.00 C ATOM 0 H THR A 121 -10.964 7.415 -7.521 1.00 0.00 H new ATOM 0 HA THR A 121 -10.563 9.899 -6.029 1.00 0.00 H new ATOM 0 HB THR A 121 -9.557 8.082 -4.275 1.00 0.00 H new ATOM 0 HG1 THR A 121 -10.504 6.279 -5.273 1.00 0.00 H new ATOM 0 HG21 THR A 121 -11.608 8.572 -2.880 1.00 0.00 H new ATOM 0 HG22 THR A 121 -11.010 10.026 -3.715 1.00 0.00 H new ATOM 0 HG23 THR A 121 -12.430 9.159 -4.346 1.00 0.00 H new ATOM 1784 N ASP A 122 -8.099 9.720 -6.023 1.00 0.00 N ATOM 1785 CA ASP A 122 -6.645 9.628 -5.920 1.00 0.00 C ATOM 1786 C ASP A 122 -6.349 8.715 -4.722 1.00 0.00 C ATOM 1787 O ASP A 122 -5.789 9.140 -3.712 1.00 0.00 O ATOM 1788 CB ASP A 122 -6.004 11.022 -5.745 1.00 0.00 C ATOM 1789 CG ASP A 122 -6.505 12.041 -6.757 1.00 0.00 C ATOM 1790 OD1 ASP A 122 -5.974 12.123 -7.886 1.00 0.00 O ATOM 1791 OD2 ASP A 122 -7.491 12.738 -6.445 1.00 0.00 O ATOM 0 H ASP A 122 -8.468 10.602 -5.669 1.00 0.00 H new ATOM 0 HA ASP A 122 -6.215 9.217 -6.833 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -6.211 11.386 -4.739 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -4.922 10.931 -5.835 1.00 0.00 H new ATOM 1796 N ASP A 123 -6.887 7.497 -4.754 1.00 0.00 N ATOM 1797 CA ASP A 123 -6.719 6.483 -3.716 1.00 0.00 C ATOM 1798 C ASP A 123 -5.274 6.006 -3.668 1.00 0.00 C ATOM 1799 O ASP A 123 -4.495 6.454 -2.822 1.00 0.00 O ATOM 1800 CB ASP A 123 -7.687 5.291 -3.847 1.00 0.00 C ATOM 1801 CG ASP A 123 -8.087 4.939 -5.272 1.00 0.00 C ATOM 1802 OD1 ASP A 123 -7.228 4.414 -6.007 1.00 0.00 O ATOM 1803 OD2 ASP A 123 -9.264 5.186 -5.626 1.00 0.00 O ATOM 0 H ASP A 123 -7.470 7.179 -5.528 1.00 0.00 H new ATOM 0 HA ASP A 123 -6.973 6.967 -2.773 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -7.226 4.416 -3.389 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -8.589 5.511 -3.277 1.00 0.00 H new ATOM 1808 N LEU A 124 -4.909 5.069 -4.541 1.00 0.00 N ATOM 1809 CA LEU A 124 -3.600 4.464 -4.558 1.00 0.00 C ATOM 1810 C LEU A 124 -2.953 4.966 -5.825 1.00 0.00 C ATOM 1811 O LEU A 124 -3.210 4.469 -6.925 1.00 0.00 O ATOM 1812 CB LEU A 124 -3.675 2.940 -4.452 1.00 0.00 C ATOM 1813 CG LEU A 124 -4.302 2.394 -3.163 1.00 0.00 C ATOM 1814 CD1 LEU A 124 -3.993 0.896 -3.029 1.00 0.00 C ATOM 1815 CD2 LEU A 124 -3.794 3.095 -1.904 1.00 0.00 C ATOM 0 H LEU A 124 -5.533 4.710 -5.264 1.00 0.00 H new ATOM 0 HA LEU A 124 -2.998 4.742 -3.693 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -4.246 2.563 -5.300 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -2.666 2.538 -4.542 1.00 0.00 H new ATOM 0 HG LEU A 124 -5.374 2.577 -3.244 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -4.440 0.513 -2.112 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -4.405 0.361 -3.885 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -2.914 0.749 -2.995 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -4.276 2.663 -1.027 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -2.715 2.965 -1.826 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -4.029 4.158 -1.960 1.00 0.00 H new ATOM 1827 N ASN A 125 -2.170 6.021 -5.650 1.00 0.00 N ATOM 1828 CA ASN A 125 -1.378 6.620 -6.711 1.00 0.00 C ATOM 1829 C ASN A 125 -0.170 7.318 -6.084 1.00 0.00 C ATOM 1830 O ASN A 125 -0.014 8.540 -6.176 1.00 0.00 O ATOM 1831 CB ASN A 125 -2.241 7.552 -7.580 1.00 0.00 C ATOM 1832 CG ASN A 125 -1.576 7.731 -8.936 1.00 0.00 C ATOM 1833 OD1 ASN A 125 -2.009 7.149 -9.925 1.00 0.00 O ATOM 1834 ND2 ASN A 125 -0.504 8.494 -9.005 1.00 0.00 N ATOM 0 H ASN A 125 -2.067 6.492 -4.751 1.00 0.00 H new ATOM 0 HA ASN A 125 -1.005 5.853 -7.390 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -3.239 7.132 -7.704 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -2.360 8.518 -7.090 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -0.017 8.610 -9.894 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -0.161 8.969 -8.170 1.00 0.00 H new ATOM 1841 N LEU A 126 0.656 6.556 -5.362 1.00 0.00 N ATOM 1842 CA LEU A 126 1.887 7.047 -4.735 1.00 0.00 C ATOM 1843 C LEU A 126 3.072 6.483 -5.512 1.00 0.00 C ATOM 1844 O LEU A 126 2.975 5.356 -6.011 1.00 0.00 O ATOM 1845 CB LEU A 126 1.969 6.635 -3.256 1.00 0.00 C ATOM 1846 CG LEU A 126 0.794 7.104 -2.377 1.00 0.00 C ATOM 1847 CD1 LEU A 126 0.988 6.611 -0.940 1.00 0.00 C ATOM 1848 CD2 LEU A 126 0.628 8.627 -2.351 1.00 0.00 C ATOM 0 H LEU A 126 0.486 5.564 -5.194 1.00 0.00 H new ATOM 0 HA LEU A 126 1.897 8.137 -4.763 1.00 0.00 H new ATOM 0 HB2 LEU A 126 2.031 5.548 -3.201 1.00 0.00 H new ATOM 0 HB3 LEU A 126 2.895 7.029 -2.837 1.00 0.00 H new ATOM 0 HG LEU A 126 -0.107 6.680 -2.821 1.00 0.00 H new ATOM 0 HD11 LEU A 126 0.153 6.946 -0.324 1.00 0.00 H new ATOM 0 HD12 LEU A 126 1.030 5.522 -0.932 1.00 0.00 H new ATOM 0 HD13 LEU A 126 1.919 7.013 -0.540 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -0.217 8.890 -1.714 1.00 0.00 H new ATOM 0 HD22 LEU A 126 1.535 9.085 -1.958 1.00 0.00 H new ATOM 0 HD23 LEU A 126 0.447 8.991 -3.362 1.00 0.00 H new ATOM 1860 N TYR A 127 4.160 7.245 -5.636 1.00 0.00 N ATOM 1861 CA TYR A 127 5.326 6.848 -6.417 1.00 0.00 C ATOM 1862 C TYR A 127 6.578 7.530 -5.862 1.00 0.00 C ATOM 1863 O TYR A 127 7.133 8.462 -6.454 1.00 0.00 O ATOM 1864 CB TYR A 127 5.083 7.105 -7.917 1.00 0.00 C ATOM 1865 CG TYR A 127 5.793 6.101 -8.807 1.00 0.00 C ATOM 1866 CD1 TYR A 127 7.189 6.153 -8.988 1.00 0.00 C ATOM 1867 CD2 TYR A 127 5.050 5.083 -9.432 1.00 0.00 C ATOM 1868 CE1 TYR A 127 7.838 5.207 -9.803 1.00 0.00 C ATOM 1869 CE2 TYR A 127 5.689 4.127 -10.237 1.00 0.00 C ATOM 1870 CZ TYR A 127 7.086 4.188 -10.434 1.00 0.00 C ATOM 1871 OH TYR A 127 7.671 3.284 -11.265 1.00 0.00 O ATOM 0 H TYR A 127 4.255 8.159 -5.194 1.00 0.00 H new ATOM 0 HA TYR A 127 5.494 5.775 -6.326 1.00 0.00 H new ATOM 0 HB2 TYR A 127 4.012 7.069 -8.119 1.00 0.00 H new ATOM 0 HB3 TYR A 127 5.421 8.110 -8.169 1.00 0.00 H new ATOM 0 HD1 TYR A 127 7.765 6.924 -8.498 1.00 0.00 H new ATOM 0 HD2 TYR A 127 3.980 5.037 -9.291 1.00 0.00 H new ATOM 0 HE1 TYR A 127 8.907 5.259 -9.946 1.00 0.00 H new ATOM 0 HE2 TYR A 127 5.112 3.344 -10.706 1.00 0.00 H new ATOM 0 HH TYR A 127 6.993 2.662 -11.601 1.00 0.00 H new ATOM 1881 N TYR A 128 7.023 7.074 -4.693 1.00 0.00 N ATOM 1882 CA TYR A 128 8.298 7.483 -4.110 1.00 0.00 C ATOM 1883 C TYR A 128 9.402 6.974 -5.029 1.00 0.00 C ATOM 1884 O TYR A 128 9.321 5.823 -5.461 1.00 0.00 O ATOM 1885 CB TYR A 128 8.422 6.936 -2.676 1.00 0.00 C ATOM 1886 CG TYR A 128 7.331 7.504 -1.790 1.00 0.00 C ATOM 1887 CD1 TYR A 128 7.404 8.860 -1.416 1.00 0.00 C ATOM 1888 CD2 TYR A 128 6.171 6.754 -1.509 1.00 0.00 C ATOM 1889 CE1 TYR A 128 6.282 9.516 -0.890 1.00 0.00 C ATOM 1890 CE2 TYR A 128 5.030 7.418 -1.022 1.00 0.00 C ATOM 1891 CZ TYR A 128 5.069 8.809 -0.769 1.00 0.00 C ATOM 1892 OH TYR A 128 3.935 9.472 -0.431 1.00 0.00 O ATOM 0 H TYR A 128 6.506 6.407 -4.121 1.00 0.00 H new ATOM 0 HA TYR A 128 8.374 8.567 -4.031 1.00 0.00 H new ATOM 0 HB2 TYR A 128 8.357 5.848 -2.690 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.399 7.192 -2.267 1.00 0.00 H new ATOM 0 HD1 TYR A 128 8.332 9.399 -1.535 1.00 0.00 H new ATOM 0 HD2 TYR A 128 6.158 5.685 -1.665 1.00 0.00 H new ATOM 0 HE1 TYR A 128 6.347 10.549 -0.582 1.00 0.00 H new ATOM 0 HE2 TYR A 128 4.121 6.863 -0.841 1.00 0.00 H new ATOM 0 HH TYR A 128 4.120 10.433 -0.381 1.00 0.00 H new ATOM 1902 N ASN A 129 10.384 7.820 -5.357 1.00 0.00 N ATOM 1903 CA ASN A 129 11.568 7.478 -6.144 1.00 0.00 C ATOM 1904 C ASN A 129 12.735 8.370 -5.738 1.00 0.00 C ATOM 1905 O ASN A 129 12.599 9.055 -4.695 1.00 0.00 O ATOM 1906 CB ASN A 129 11.291 7.503 -7.657 1.00 0.00 C ATOM 1907 CG ASN A 129 11.032 8.882 -8.239 1.00 0.00 C ATOM 1908 OD1 ASN A 129 11.920 9.711 -8.397 1.00 0.00 O ATOM 1909 ND2 ASN A 129 9.793 9.186 -8.588 1.00 0.00 N ATOM 0 H ASN A 129 10.373 8.799 -5.069 1.00 0.00 H new ATOM 0 HA ASN A 129 11.844 6.447 -5.923 1.00 0.00 H new ATOM 0 HB2 ASN A 129 12.142 7.061 -8.174 1.00 0.00 H new ATOM 0 HB3 ASN A 129 10.428 6.870 -7.864 1.00 0.00 H new ATOM 0 HD21 ASN A 129 9.585 10.103 -8.984 1.00 0.00 H new ATOM 0 HD22 ASN A 129 9.045 8.504 -8.461 1.00 0.00 H new TER 1916 ASN A 129