USER MOD reduce.3.24.130724 H: found=0, std=0, add=623, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 623 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 24 GLN : amide:sc= 0 X(o=0.5,f=0.25) USER MOD Set 1.2: A 39 GLN : amide:sc=-0.00672 K(o=0.5,f=-0.27) USER MOD Set 1.3: A 42 SER OG : rot 160:sc= 0.503 USER MOD Single : A 3 THR OG1 : rot 32:sc= 0.349 USER MOD Single : A 5 THR OG1 : rot -130:sc= 0.805 USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 LYS NZ :NH3+ 168:sc= 2.51 (180deg=2.29) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ -166:sc= -0.0697 (180deg=-0.323) USER MOD Single : A 20 ASN : amide:sc= -1.27 K(o=-1.3,f=-6.3!) USER MOD Single : A 21 ASN : amide:sc= -0.329 K(o=-0.33,f=-2.9!) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= -0.0846 X(o=-0.085,f=-0.29) USER MOD Single : A 33 GLN : amide:sc= -1.56! K(o=-1.6!,f=-0.54) USER MOD Single : A 36 HIS : no HD1:sc= -0.405 X(o=-0.4,f=-0.0071) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot 73:sc= 0.149 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot 70:sc= -1.13 USER MOD Single : A 53 TYR OH : rot 171:sc= -1.29 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ -164:sc= 0.582 (180deg=0.233) USER MOD Single : A 63 THR OG1 : rot 180:sc=-0.00892 USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ 144:sc= 1.33 (180deg=0.843) USER MOD Single : A 73 ASN : amide:sc= 0 K(o=0,f=-1.6) USER MOD Single : A 74 ASN : amide:sc= -0.608 K(o=-0.61,f=-1.6!) USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 78 GLN : amide:sc= 1.11 K(o=1.1,f=-0.87) USER MOD Single : A 79 ASN : amide:sc= 0.444 K(o=0.44,f=-8.5!) USER MOD Single : A 81 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 35 N THR A 3 5.950 -18.843 -17.009 1.00 72.00 N ATOM 36 CA THR A 3 5.438 -18.566 -18.314 1.00 22.00 C ATOM 37 C THR A 3 4.619 -17.316 -18.171 1.00 73.00 C ATOM 38 O THR A 3 3.925 -17.153 -17.164 1.00 53.00 O ATOM 39 CB THR A 3 4.529 -19.714 -18.823 1.00 62.00 C ATOM 40 OG1 THR A 3 5.109 -20.985 -18.461 1.00 42.00 O ATOM 41 CG2 THR A 3 4.448 -19.663 -20.337 1.00 64.00 C ATOM 0 HA THR A 3 6.253 -18.459 -19.030 1.00 22.00 H new ATOM 0 HB THR A 3 3.540 -19.601 -18.380 1.00 62.00 H new ATOM 0 HG1 THR A 3 5.599 -20.893 -17.617 1.00 42.00 H new ATOM 0 HG21 THR A 3 3.809 -20.470 -20.695 1.00 64.00 H new ATOM 0 HG22 THR A 3 4.030 -18.705 -20.647 1.00 64.00 H new ATOM 0 HG23 THR A 3 5.447 -19.777 -20.759 1.00 64.00 H new ATOM 49 N ASP A 4 4.757 -16.424 -19.104 1.00 11.00 N ATOM 50 CA ASP A 4 4.006 -15.192 -19.102 1.00 61.00 C ATOM 51 C ASP A 4 2.558 -15.516 -19.420 1.00 61.00 C ATOM 52 O ASP A 4 2.280 -16.361 -20.278 1.00 63.00 O ATOM 53 CB ASP A 4 4.579 -14.207 -20.140 1.00 3.00 C ATOM 54 CG ASP A 4 5.876 -13.532 -19.756 1.00 22.00 C ATOM 55 OD1 ASP A 4 6.936 -14.200 -19.778 1.00 31.00 O ATOM 56 OD2 ASP A 4 5.879 -12.316 -19.500 1.00 53.00 O ATOM 0 H ASP A 4 5.394 -16.524 -19.894 1.00 11.00 H new ATOM 0 HA ASP A 4 4.075 -14.718 -18.123 1.00 61.00 H new ATOM 0 HB2 ASP A 4 4.733 -14.743 -21.076 1.00 3.00 H new ATOM 0 HB3 ASP A 4 3.833 -13.436 -20.333 1.00 3.00 H new ATOM 61 N THR A 5 1.656 -14.905 -18.729 1.00 60.00 N ATOM 62 CA THR A 5 0.262 -15.145 -18.934 1.00 64.00 C ATOM 63 C THR A 5 -0.516 -13.868 -18.732 1.00 52.00 C ATOM 64 O THR A 5 -0.074 -12.958 -18.044 1.00 72.00 O ATOM 65 CB THR A 5 -0.292 -16.276 -18.007 1.00 22.00 C ATOM 66 OG1 THR A 5 -1.715 -16.458 -18.229 1.00 34.00 O ATOM 67 CG2 THR A 5 -0.048 -15.964 -16.531 1.00 64.00 C ATOM 0 H THR A 5 1.863 -14.221 -18.001 1.00 60.00 H new ATOM 0 HA THR A 5 0.138 -15.488 -19.961 1.00 64.00 H new ATOM 0 HB THR A 5 0.241 -17.193 -18.259 1.00 22.00 H new ATOM 0 HG1 THR A 5 -2.184 -16.452 -17.368 1.00 34.00 H new ATOM 0 HG21 THR A 5 -0.446 -16.772 -15.918 1.00 64.00 H new ATOM 0 HG22 THR A 5 1.023 -15.867 -16.352 1.00 64.00 H new ATOM 0 HG23 THR A 5 -0.546 -15.030 -16.269 1.00 64.00 H new ATOM 75 N LEU A 6 -1.653 -13.783 -19.362 1.00 43.00 N ATOM 76 CA LEU A 6 -2.482 -12.660 -19.236 1.00 32.00 C ATOM 77 C LEU A 6 -3.258 -12.624 -17.910 1.00 64.00 C ATOM 78 O LEU A 6 -2.955 -13.383 -16.996 1.00 73.00 O ATOM 79 CB LEU A 6 -3.315 -12.461 -20.502 1.00 42.00 C ATOM 80 CG LEU A 6 -2.527 -11.781 -21.645 1.00 44.00 C ATOM 81 CD1 LEU A 6 -1.364 -12.590 -22.209 1.00 61.00 C ATOM 82 CD2 LEU A 6 -3.412 -11.183 -22.712 1.00 64.00 C ATOM 0 H LEU A 6 -2.018 -14.509 -19.979 1.00 43.00 H new ATOM 0 HA LEU A 6 -1.854 -11.772 -19.160 1.00 32.00 H new ATOM 0 HB2 LEU A 6 -3.680 -13.429 -20.846 1.00 42.00 H new ATOM 0 HB3 LEU A 6 -4.190 -11.857 -20.263 1.00 42.00 H new ATOM 0 HG LEU A 6 -2.039 -10.940 -21.151 1.00 44.00 H new ATOM 0 HD11 LEU A 6 -0.879 -12.024 -23.004 1.00 61.00 H new ATOM 0 HD12 LEU A 6 -0.644 -12.793 -21.416 1.00 61.00 H new ATOM 0 HD13 LEU A 6 -1.737 -13.532 -22.610 1.00 61.00 H new ATOM 0 HD21 LEU A 6 -2.793 -10.723 -23.482 1.00 64.00 H new ATOM 0 HD22 LEU A 6 -4.024 -11.967 -23.159 1.00 64.00 H new ATOM 0 HD23 LEU A 6 -4.059 -10.427 -22.267 1.00 64.00 H new ATOM 94 N GLU A 7 -4.296 -11.782 -17.830 1.00 44.00 N ATOM 95 CA GLU A 7 -4.957 -11.465 -16.572 1.00 61.00 C ATOM 96 C GLU A 7 -5.797 -12.661 -16.095 1.00 4.00 C ATOM 97 O GLU A 7 -6.344 -12.685 -14.989 1.00 35.00 O ATOM 98 CB GLU A 7 -5.831 -10.216 -16.762 1.00 14.00 C ATOM 99 CG GLU A 7 -6.411 -9.719 -15.465 1.00 32.00 C ATOM 100 CD GLU A 7 -7.275 -8.492 -15.587 1.00 41.00 C ATOM 101 OE1 GLU A 7 -8.485 -8.634 -15.817 1.00 71.00 O ATOM 102 OE2 GLU A 7 -6.780 -7.384 -15.379 1.00 23.00 O ATOM 0 H GLU A 7 -4.696 -11.305 -18.638 1.00 44.00 H new ATOM 0 HA GLU A 7 -4.209 -11.259 -15.806 1.00 61.00 H new ATOM 0 HB2 GLU A 7 -5.235 -9.425 -17.217 1.00 14.00 H new ATOM 0 HB3 GLU A 7 -6.641 -10.444 -17.455 1.00 14.00 H new ATOM 0 HG2 GLU A 7 -7.001 -10.519 -15.018 1.00 32.00 H new ATOM 0 HG3 GLU A 7 -5.594 -9.503 -14.777 1.00 32.00 H new ATOM 109 N TYR A 8 -5.851 -13.650 -16.969 1.00 32.00 N ATOM 110 CA TYR A 8 -6.537 -14.911 -16.823 1.00 43.00 C ATOM 111 C TYR A 8 -8.004 -14.840 -16.402 1.00 34.00 C ATOM 112 O TYR A 8 -8.591 -15.842 -15.982 1.00 65.00 O ATOM 113 CB TYR A 8 -5.722 -15.979 -16.063 1.00 72.00 C ATOM 114 CG TYR A 8 -5.263 -15.612 -14.654 1.00 52.00 C ATOM 115 CD1 TYR A 8 -6.132 -15.687 -13.575 1.00 61.00 C ATOM 116 CD2 TYR A 8 -3.957 -15.193 -14.411 1.00 32.00 C ATOM 117 CE1 TYR A 8 -5.721 -15.356 -12.300 1.00 32.00 C ATOM 118 CE2 TYR A 8 -3.539 -14.860 -13.136 1.00 74.00 C ATOM 119 CZ TYR A 8 -4.426 -14.943 -12.086 1.00 41.00 C ATOM 120 OH TYR A 8 -4.017 -14.611 -10.806 1.00 23.00 O ATOM 0 H TYR A 8 -5.377 -13.581 -17.869 1.00 32.00 H new ATOM 0 HA TYR A 8 -6.604 -15.264 -17.852 1.00 43.00 H new ATOM 0 HB2 TYR A 8 -6.323 -16.886 -16.000 1.00 72.00 H new ATOM 0 HB3 TYR A 8 -4.840 -16.221 -16.656 1.00 72.00 H new ATOM 0 HD1 TYR A 8 -7.150 -16.011 -13.736 1.00 61.00 H new ATOM 0 HD2 TYR A 8 -3.259 -15.127 -15.233 1.00 32.00 H new ATOM 0 HE1 TYR A 8 -6.413 -15.421 -11.473 1.00 32.00 H new ATOM 0 HE2 TYR A 8 -2.523 -14.537 -12.965 1.00 74.00 H new ATOM 0 HH TYR A 8 -3.075 -14.341 -10.823 1.00 23.00 H new ATOM 130 N GLN A 9 -8.613 -13.718 -16.640 1.00 51.00 N ATOM 131 CA GLN A 9 -9.928 -13.478 -16.333 1.00 73.00 C ATOM 132 C GLN A 9 -10.357 -12.413 -17.267 1.00 34.00 C ATOM 133 O GLN A 9 -9.779 -11.338 -17.302 1.00 62.00 O ATOM 134 CB GLN A 9 -10.097 -13.026 -14.891 1.00 4.00 C ATOM 135 CG GLN A 9 -11.500 -12.589 -14.616 1.00 11.00 C ATOM 136 CD GLN A 9 -11.754 -12.190 -13.180 1.00 41.00 C ATOM 137 OE1 GLN A 9 -12.123 -13.017 -12.355 1.00 63.00 O ATOM 138 NE2 GLN A 9 -11.551 -10.940 -12.868 1.00 70.00 N ATOM 0 H GLN A 9 -8.150 -12.922 -17.079 1.00 51.00 H new ATOM 0 HA GLN A 9 -10.528 -14.383 -16.433 1.00 73.00 H new ATOM 0 HB2 GLN A 9 -9.830 -13.842 -14.219 1.00 4.00 H new ATOM 0 HB3 GLN A 9 -9.411 -12.205 -14.683 1.00 4.00 H new ATOM 0 HG2 GLN A 9 -11.740 -11.746 -15.264 1.00 11.00 H new ATOM 0 HG3 GLN A 9 -12.180 -13.398 -14.882 1.00 11.00 H new ATOM 0 HE21 GLN A 9 -11.244 -10.280 -13.582 1.00 70.00 H new ATOM 0 HE22 GLN A 9 -11.699 -10.623 -11.910 1.00 70.00 H new ATOM 147 N CYS A 10 -11.260 -12.737 -18.069 1.00 61.00 N ATOM 148 CA CYS A 10 -11.798 -11.836 -19.001 1.00 32.00 C ATOM 149 C CYS A 10 -13.297 -11.899 -18.843 1.00 2.00 C ATOM 150 O CYS A 10 -13.787 -12.745 -18.072 1.00 15.00 O ATOM 151 CB CYS A 10 -11.345 -12.217 -20.401 1.00 2.00 C ATOM 152 SG CYS A 10 -9.565 -12.047 -20.716 1.00 74.00 S ATOM 0 H CYS A 10 -11.671 -13.670 -18.108 1.00 61.00 H new ATOM 0 HA CYS A 10 -11.457 -10.814 -18.834 1.00 32.00 H new ATOM 0 HB2 CYS A 10 -11.633 -13.251 -20.589 1.00 2.00 H new ATOM 0 HB3 CYS A 10 -11.885 -11.600 -21.120 1.00 2.00 H new ATOM 157 N ASP A 11 -14.024 -11.046 -19.535 1.00 22.00 N ATOM 158 CA ASP A 11 -15.482 -10.939 -19.356 1.00 11.00 C ATOM 159 C ASP A 11 -16.241 -12.254 -19.545 1.00 74.00 C ATOM 160 O ASP A 11 -17.101 -12.592 -18.741 1.00 12.00 O ATOM 161 CB ASP A 11 -16.081 -9.851 -20.247 1.00 43.00 C ATOM 162 CG ASP A 11 -17.575 -9.692 -20.038 1.00 14.00 C ATOM 163 OD1 ASP A 11 -17.988 -9.197 -18.972 1.00 40.00 O ATOM 164 OD2 ASP A 11 -18.357 -10.086 -20.912 1.00 54.00 O ATOM 0 H ASP A 11 -13.640 -10.409 -20.232 1.00 22.00 H new ATOM 0 HA ASP A 11 -15.611 -10.661 -18.310 1.00 11.00 H new ATOM 0 HB2 ASP A 11 -15.585 -8.902 -20.041 1.00 43.00 H new ATOM 0 HB3 ASP A 11 -15.886 -10.093 -21.292 1.00 43.00 H new ATOM 169 N GLU A 12 -15.912 -13.009 -20.572 1.00 44.00 N ATOM 170 CA GLU A 12 -16.684 -14.228 -20.868 1.00 74.00 C ATOM 171 C GLU A 12 -15.823 -15.464 -20.807 1.00 52.00 C ATOM 172 O GLU A 12 -16.319 -16.584 -20.934 1.00 24.00 O ATOM 173 CB GLU A 12 -17.212 -14.148 -22.280 1.00 63.00 C ATOM 174 CG GLU A 12 -17.754 -12.806 -22.640 1.00 54.00 C ATOM 175 CD GLU A 12 -18.277 -12.749 -24.041 1.00 3.00 C ATOM 176 OE1 GLU A 12 -17.533 -13.099 -24.972 1.00 65.00 O ATOM 177 OE2 GLU A 12 -19.437 -12.309 -24.240 1.00 51.00 O ATOM 0 H GLU A 12 -15.138 -12.820 -21.209 1.00 44.00 H new ATOM 0 HA GLU A 12 -17.480 -14.293 -20.127 1.00 74.00 H new ATOM 0 HB2 GLU A 12 -16.411 -14.405 -22.973 1.00 63.00 H new ATOM 0 HB3 GLU A 12 -17.997 -14.894 -22.408 1.00 63.00 H new ATOM 0 HG2 GLU A 12 -18.554 -12.545 -21.947 1.00 54.00 H new ATOM 0 HG3 GLU A 12 -16.970 -12.058 -22.519 1.00 54.00 H new ATOM 184 N LYS A 13 -14.548 -15.272 -20.661 1.00 70.00 N ATOM 185 CA LYS A 13 -13.593 -16.356 -20.796 1.00 43.00 C ATOM 186 C LYS A 13 -12.456 -16.129 -19.844 1.00 60.00 C ATOM 187 O LYS A 13 -12.185 -14.990 -19.491 1.00 25.00 O ATOM 188 CB LYS A 13 -13.034 -16.325 -22.229 1.00 4.00 C ATOM 189 CG LYS A 13 -14.070 -16.569 -23.312 1.00 63.00 C ATOM 190 CD LYS A 13 -14.199 -18.037 -23.639 1.00 62.00 C ATOM 191 CE LYS A 13 -15.603 -18.405 -24.052 1.00 72.00 C ATOM 192 NZ LYS A 13 -16.491 -18.554 -22.880 1.00 33.00 N ATOM 0 H LYS A 13 -14.130 -14.367 -20.446 1.00 70.00 H new ATOM 0 HA LYS A 13 -14.074 -17.311 -20.584 1.00 43.00 H new ATOM 0 HB2 LYS A 13 -12.566 -15.356 -22.403 1.00 4.00 H new ATOM 0 HB3 LYS A 13 -12.250 -17.078 -22.317 1.00 4.00 H new ATOM 0 HG2 LYS A 13 -15.036 -16.182 -22.986 1.00 63.00 H new ATOM 0 HG3 LYS A 13 -13.793 -16.019 -24.211 1.00 63.00 H new ATOM 0 HD2 LYS A 13 -13.507 -18.291 -24.442 1.00 62.00 H new ATOM 0 HD3 LYS A 13 -13.910 -18.628 -22.770 1.00 62.00 H new ATOM 0 HE2 LYS A 13 -16.001 -17.638 -24.716 1.00 72.00 H new ATOM 0 HE3 LYS A 13 -15.585 -19.337 -24.617 1.00 72.00 H new ATOM 0 HZ1 LYS A 13 -17.480 -18.605 -23.198 1.00 33.00 H new ATOM 0 HZ2 LYS A 13 -16.247 -19.426 -22.368 1.00 33.00 H new ATOM 0 HZ3 LYS A 13 -16.372 -17.737 -22.248 1.00 33.00 H new ATOM 206 N PRO A 14 -11.819 -17.168 -19.350 1.00 62.00 N ATOM 207 CA PRO A 14 -10.611 -17.009 -18.605 1.00 23.00 C ATOM 208 C PRO A 14 -9.408 -17.104 -19.574 1.00 31.00 C ATOM 209 O PRO A 14 -9.256 -18.093 -20.276 1.00 63.00 O ATOM 210 CB PRO A 14 -10.635 -18.179 -17.614 1.00 70.00 C ATOM 211 CG PRO A 14 -11.583 -19.204 -18.202 1.00 22.00 C ATOM 212 CD PRO A 14 -12.235 -18.581 -19.425 1.00 42.00 C ATOM 0 HA PRO A 14 -10.525 -16.051 -18.092 1.00 23.00 H new ATOM 0 HB2 PRO A 14 -9.638 -18.600 -17.483 1.00 70.00 H new ATOM 0 HB3 PRO A 14 -10.975 -17.851 -16.632 1.00 70.00 H new ATOM 0 HG2 PRO A 14 -11.044 -20.111 -18.476 1.00 22.00 H new ATOM 0 HG3 PRO A 14 -12.338 -19.491 -17.470 1.00 22.00 H new ATOM 0 HD2 PRO A 14 -11.894 -19.052 -20.347 1.00 42.00 H new ATOM 0 HD3 PRO A 14 -13.320 -18.683 -19.398 1.00 42.00 H new ATOM 220 N LEU A 15 -8.544 -16.113 -19.598 1.00 32.00 N ATOM 221 CA LEU A 15 -7.526 -16.089 -20.603 1.00 42.00 C ATOM 222 C LEU A 15 -6.220 -16.378 -19.999 1.00 13.00 C ATOM 223 O LEU A 15 -5.514 -15.471 -19.536 1.00 31.00 O ATOM 224 CB LEU A 15 -7.466 -14.750 -21.314 1.00 63.00 C ATOM 225 CG LEU A 15 -6.423 -14.635 -22.445 1.00 5.00 C ATOM 226 CD1 LEU A 15 -6.643 -15.698 -23.516 1.00 32.00 C ATOM 227 CD2 LEU A 15 -6.445 -13.250 -23.058 1.00 24.00 C ATOM 0 H LEU A 15 -8.531 -15.331 -18.943 1.00 32.00 H new ATOM 0 HA LEU A 15 -7.775 -16.853 -21.340 1.00 42.00 H new ATOM 0 HB2 LEU A 15 -8.450 -14.537 -21.731 1.00 63.00 H new ATOM 0 HB3 LEU A 15 -7.259 -13.977 -20.575 1.00 63.00 H new ATOM 0 HG LEU A 15 -5.440 -14.803 -22.005 1.00 5.00 H new ATOM 0 HD11 LEU A 15 -5.891 -15.588 -24.297 1.00 32.00 H new ATOM 0 HD12 LEU A 15 -6.559 -16.688 -23.068 1.00 32.00 H new ATOM 0 HD13 LEU A 15 -7.636 -15.578 -23.949 1.00 32.00 H new ATOM 0 HD21 LEU A 15 -5.702 -13.192 -23.853 1.00 24.00 H new ATOM 0 HD22 LEU A 15 -7.434 -13.050 -23.471 1.00 24.00 H new ATOM 0 HD23 LEU A 15 -6.215 -12.509 -22.292 1.00 24.00 H new ATOM 239 N THR A 16 -5.905 -17.602 -19.921 1.00 5.00 N ATOM 240 CA THR A 16 -4.656 -17.934 -19.400 1.00 44.00 C ATOM 241 C THR A 16 -3.772 -18.283 -20.591 1.00 21.00 C ATOM 242 O THR A 16 -4.193 -19.041 -21.478 1.00 54.00 O ATOM 243 CB THR A 16 -4.759 -19.080 -18.402 1.00 64.00 C ATOM 244 OG1 THR A 16 -5.966 -18.882 -17.641 1.00 10.00 O ATOM 245 CG2 THR A 16 -3.588 -19.018 -17.443 1.00 65.00 C ATOM 0 H THR A 16 -6.491 -18.386 -20.209 1.00 5.00 H new ATOM 0 HA THR A 16 -4.227 -17.103 -18.840 1.00 44.00 H new ATOM 0 HB THR A 16 -4.762 -20.038 -18.923 1.00 64.00 H new ATOM 0 HG1 THR A 16 -6.064 -19.606 -16.988 1.00 10.00 H new ATOM 0 HG21 THR A 16 -3.660 -19.837 -16.728 1.00 65.00 H new ATOM 0 HG22 THR A 16 -2.656 -19.104 -18.001 1.00 65.00 H new ATOM 0 HG23 THR A 16 -3.605 -18.068 -16.909 1.00 65.00 H new ATOM 253 N VAL A 17 -2.605 -17.711 -20.643 1.00 54.00 N ATOM 254 CA VAL A 17 -1.762 -17.836 -21.803 1.00 34.00 C ATOM 255 C VAL A 17 -0.428 -18.425 -21.433 1.00 1.00 C ATOM 256 O VAL A 17 0.042 -18.252 -20.327 1.00 22.00 O ATOM 257 CB VAL A 17 -1.561 -16.441 -22.499 1.00 62.00 C ATOM 258 CG1 VAL A 17 -0.621 -16.526 -23.694 1.00 42.00 C ATOM 259 CG2 VAL A 17 -2.901 -15.877 -22.942 1.00 54.00 C ATOM 0 H VAL A 17 -2.210 -17.148 -19.890 1.00 54.00 H new ATOM 0 HA VAL A 17 -2.256 -18.508 -22.505 1.00 34.00 H new ATOM 0 HB VAL A 17 -1.106 -15.777 -21.764 1.00 62.00 H new ATOM 0 HG11 VAL A 17 -0.513 -15.539 -24.143 1.00 42.00 H new ATOM 0 HG12 VAL A 17 0.354 -16.884 -23.365 1.00 42.00 H new ATOM 0 HG13 VAL A 17 -1.031 -17.216 -24.431 1.00 42.00 H new ATOM 0 HG21 VAL A 17 -2.748 -14.911 -23.423 1.00 54.00 H new ATOM 0 HG22 VAL A 17 -3.369 -16.563 -23.648 1.00 54.00 H new ATOM 0 HG23 VAL A 17 -3.548 -15.752 -22.074 1.00 54.00 H new ATOM 269 N LYS A 18 0.138 -19.166 -22.335 1.00 55.00 N ATOM 270 CA LYS A 18 1.449 -19.652 -22.182 1.00 21.00 C ATOM 271 C LYS A 18 2.288 -18.902 -23.138 1.00 65.00 C ATOM 272 O LYS A 18 2.552 -19.357 -24.244 1.00 31.00 O ATOM 273 CB LYS A 18 1.580 -21.174 -22.385 1.00 1.00 C ATOM 274 CG LYS A 18 1.037 -22.038 -21.242 1.00 71.00 C ATOM 275 CD LYS A 18 -0.456 -21.877 -21.032 1.00 12.00 C ATOM 276 CE LYS A 18 -0.971 -22.770 -19.918 1.00 70.00 C ATOM 277 NZ LYS A 18 -0.726 -24.198 -20.191 1.00 64.00 N ATOM 0 H LYS A 18 -0.315 -19.447 -23.205 1.00 55.00 H new ATOM 0 HA LYS A 18 1.772 -19.496 -21.153 1.00 21.00 H new ATOM 0 HB2 LYS A 18 1.060 -21.447 -23.303 1.00 1.00 H new ATOM 0 HB3 LYS A 18 2.633 -21.415 -22.531 1.00 1.00 H new ATOM 0 HG2 LYS A 18 1.258 -23.085 -21.450 1.00 71.00 H new ATOM 0 HG3 LYS A 18 1.558 -21.779 -20.320 1.00 71.00 H new ATOM 0 HD2 LYS A 18 -0.679 -20.837 -20.796 1.00 12.00 H new ATOM 0 HD3 LYS A 18 -0.980 -22.113 -21.958 1.00 12.00 H new ATOM 0 HE2 LYS A 18 -0.489 -22.493 -18.980 1.00 70.00 H new ATOM 0 HE3 LYS A 18 -2.040 -22.605 -19.787 1.00 70.00 H new ATOM 0 HZ1 LYS A 18 -1.291 -24.778 -19.539 1.00 64.00 H new ATOM 0 HZ2 LYS A 18 -0.997 -24.415 -21.171 1.00 64.00 H new ATOM 0 HZ3 LYS A 18 0.283 -24.409 -20.056 1.00 64.00 H new ATOM 291 N LEU A 19 2.550 -17.684 -22.767 1.00 4.00 N ATOM 292 CA LEU A 19 3.315 -16.801 -23.505 1.00 70.00 C ATOM 293 C LEU A 19 4.743 -17.100 -23.185 1.00 50.00 C ATOM 294 O LEU A 19 5.254 -16.782 -22.101 1.00 64.00 O ATOM 295 CB LEU A 19 2.945 -15.407 -23.061 1.00 5.00 C ATOM 296 CG LEU A 19 3.124 -14.273 -24.039 1.00 71.00 C ATOM 297 CD1 LEU A 19 2.588 -12.983 -23.447 1.00 41.00 C ATOM 298 CD2 LEU A 19 4.560 -14.106 -24.516 1.00 2.00 C ATOM 0 H LEU A 19 2.205 -17.287 -21.893 1.00 4.00 H new ATOM 0 HA LEU A 19 3.153 -16.888 -24.579 1.00 70.00 H new ATOM 0 HB2 LEU A 19 1.898 -15.422 -22.757 1.00 5.00 H new ATOM 0 HB3 LEU A 19 3.531 -15.175 -22.172 1.00 5.00 H new ATOM 0 HG LEU A 19 2.547 -14.528 -24.928 1.00 71.00 H new ATOM 0 HD11 LEU A 19 2.723 -12.171 -24.162 1.00 41.00 H new ATOM 0 HD12 LEU A 19 1.527 -13.098 -23.224 1.00 41.00 H new ATOM 0 HD13 LEU A 19 3.129 -12.752 -22.529 1.00 41.00 H new ATOM 0 HD21 LEU A 19 4.616 -13.273 -25.217 1.00 2.00 H new ATOM 0 HD22 LEU A 19 5.206 -13.906 -23.661 1.00 2.00 H new ATOM 0 HD23 LEU A 19 4.887 -15.020 -25.012 1.00 2.00 H new ATOM 310 N ASN A 20 5.337 -17.790 -24.050 1.00 11.00 N ATOM 311 CA ASN A 20 6.722 -18.122 -23.903 1.00 21.00 C ATOM 312 C ASN A 20 7.519 -16.928 -24.425 1.00 23.00 C ATOM 313 O ASN A 20 7.405 -16.570 -25.578 1.00 61.00 O ATOM 314 CB ASN A 20 7.031 -19.417 -24.683 1.00 20.00 C ATOM 315 CG ASN A 20 8.420 -19.995 -24.436 1.00 63.00 C ATOM 316 OD1 ASN A 20 9.378 -19.280 -24.183 1.00 2.00 O ATOM 317 ND2 ASN A 20 8.532 -21.299 -24.484 1.00 15.00 N ATOM 0 H ASN A 20 4.898 -18.156 -24.895 1.00 11.00 H new ATOM 0 HA ASN A 20 6.990 -18.313 -22.864 1.00 21.00 H new ATOM 0 HB2 ASN A 20 6.287 -20.169 -24.420 1.00 20.00 H new ATOM 0 HB3 ASN A 20 6.920 -19.218 -25.749 1.00 20.00 H new ATOM 0 HD21 ASN A 20 9.435 -21.740 -24.308 1.00 15.00 H new ATOM 0 HD22 ASN A 20 7.717 -21.873 -24.697 1.00 15.00 H new ATOM 324 N ASN A 21 8.256 -16.273 -23.557 1.00 72.00 N ATOM 325 CA ASN A 21 9.002 -15.071 -23.948 1.00 71.00 C ATOM 326 C ASN A 21 10.155 -15.405 -24.932 1.00 12.00 C ATOM 327 O ASN A 21 10.180 -14.862 -26.031 1.00 2.00 O ATOM 328 CB ASN A 21 9.475 -14.277 -22.693 1.00 40.00 C ATOM 329 CG ASN A 21 10.169 -12.928 -22.984 1.00 42.00 C ATOM 330 OD1 ASN A 21 10.842 -12.738 -23.999 1.00 32.00 O ATOM 331 ND2 ASN A 21 10.014 -11.988 -22.084 1.00 4.00 N ATOM 0 H ASN A 21 8.363 -16.540 -22.578 1.00 72.00 H new ATOM 0 HA ASN A 21 8.328 -14.413 -24.497 1.00 71.00 H new ATOM 0 HB2 ASN A 21 8.611 -14.091 -22.055 1.00 40.00 H new ATOM 0 HB3 ASN A 21 10.162 -14.904 -22.125 1.00 40.00 H new ATOM 0 HD21 ASN A 21 10.455 -11.078 -22.216 1.00 4.00 H new ATOM 0 HD22 ASN A 21 9.453 -12.167 -21.251 1.00 4.00 H new ATOM 338 N PRO A 22 11.121 -16.321 -24.585 1.00 1.00 N ATOM 339 CA PRO A 22 12.198 -16.709 -25.515 1.00 11.00 C ATOM 340 C PRO A 22 11.703 -17.436 -26.782 1.00 31.00 C ATOM 341 O PRO A 22 12.447 -17.602 -27.740 1.00 43.00 O ATOM 342 CB PRO A 22 13.081 -17.643 -24.705 1.00 63.00 C ATOM 343 CG PRO A 22 12.259 -18.074 -23.563 1.00 1.00 C ATOM 344 CD PRO A 22 11.304 -16.964 -23.273 1.00 45.00 C ATOM 0 HA PRO A 22 12.706 -15.819 -25.885 1.00 11.00 H new ATOM 0 HB2 PRO A 22 13.400 -18.497 -25.303 1.00 63.00 H new ATOM 0 HB3 PRO A 22 13.984 -17.134 -24.368 1.00 63.00 H new ATOM 0 HG2 PRO A 22 11.723 -18.993 -23.798 1.00 1.00 H new ATOM 0 HG3 PRO A 22 12.884 -18.283 -22.695 1.00 1.00 H new ATOM 0 HD2 PRO A 22 10.361 -17.339 -22.874 1.00 45.00 H new ATOM 0 HD3 PRO A 22 11.708 -16.268 -22.537 1.00 45.00 H new ATOM 352 N ARG A 23 10.458 -17.842 -26.778 1.00 0.00 N ATOM 353 CA ARG A 23 9.850 -18.532 -27.884 1.00 14.00 C ATOM 354 C ARG A 23 8.439 -18.038 -28.009 1.00 30.00 C ATOM 355 O ARG A 23 7.525 -18.641 -27.507 1.00 10.00 O ATOM 356 CB ARG A 23 9.891 -20.057 -27.726 1.00 11.00 C ATOM 357 CG ARG A 23 9.133 -20.800 -28.822 1.00 3.00 C ATOM 358 CD ARG A 23 9.055 -22.289 -28.575 1.00 24.00 C ATOM 359 NE ARG A 23 8.050 -22.891 -29.448 1.00 50.00 N ATOM 360 CZ ARG A 23 7.701 -24.169 -29.486 1.00 14.00 C ATOM 361 NH1 ARG A 23 8.443 -25.092 -28.885 1.00 0.00 N ATOM 362 NH2 ARG A 23 6.612 -24.521 -30.161 1.00 54.00 N ATOM 0 H ARG A 23 9.828 -17.698 -25.989 1.00 0.00 H new ATOM 0 HA ARG A 23 10.415 -18.319 -28.791 1.00 14.00 H new ATOM 0 HB2 ARG A 23 10.930 -20.387 -27.725 1.00 11.00 H new ATOM 0 HB3 ARG A 23 9.470 -20.326 -26.757 1.00 11.00 H new ATOM 0 HG2 ARG A 23 8.124 -20.396 -28.897 1.00 3.00 H new ATOM 0 HG3 ARG A 23 9.621 -20.620 -29.780 1.00 3.00 H new ATOM 0 HD2 ARG A 23 10.027 -22.747 -28.757 1.00 24.00 H new ATOM 0 HD3 ARG A 23 8.803 -22.480 -27.532 1.00 24.00 H new ATOM 0 HE ARG A 23 7.568 -22.265 -30.093 1.00 50.00 H new ATOM 0 HH11 ARG A 23 9.291 -24.820 -28.388 1.00 0.00 H new ATOM 0 HH12 ARG A 23 8.165 -26.073 -28.921 1.00 0.00 H new ATOM 0 HH21 ARG A 23 6.058 -23.812 -30.641 1.00 54.00 H new ATOM 0 HH22 ARG A 23 6.330 -25.501 -30.200 1.00 54.00 H new ATOM 376 N GLN A 24 8.380 -16.826 -28.506 1.00 30.00 N ATOM 377 CA GLN A 24 7.212 -15.949 -28.837 1.00 1.00 C ATOM 378 C GLN A 24 6.020 -16.657 -29.481 1.00 42.00 C ATOM 379 O GLN A 24 5.572 -16.371 -30.618 1.00 31.00 O ATOM 380 CB GLN A 24 7.687 -14.746 -29.666 1.00 21.00 C ATOM 381 CG GLN A 24 8.495 -15.126 -30.901 1.00 33.00 C ATOM 382 CD GLN A 24 9.104 -13.942 -31.623 1.00 34.00 C ATOM 383 OE1 GLN A 24 8.576 -12.830 -31.604 1.00 53.00 O ATOM 384 NE2 GLN A 24 10.207 -14.169 -32.279 1.00 12.00 N ATOM 0 H GLN A 24 9.249 -16.341 -28.728 1.00 30.00 H new ATOM 0 HA GLN A 24 6.813 -15.606 -27.882 1.00 1.00 H new ATOM 0 HB2 GLN A 24 6.818 -14.166 -29.977 1.00 21.00 H new ATOM 0 HB3 GLN A 24 8.293 -14.098 -29.033 1.00 21.00 H new ATOM 0 HG2 GLN A 24 9.292 -15.809 -30.606 1.00 33.00 H new ATOM 0 HG3 GLN A 24 7.850 -15.669 -31.592 1.00 33.00 H new ATOM 0 HE21 GLN A 24 10.620 -15.102 -32.275 1.00 12.00 H new ATOM 0 HE22 GLN A 24 10.657 -13.414 -32.796 1.00 12.00 H new ATOM 393 N GLU A 25 5.602 -17.587 -28.770 1.00 12.00 N ATOM 394 CA GLU A 25 4.421 -18.384 -28.996 1.00 32.00 C ATOM 395 C GLU A 25 3.536 -18.353 -27.781 1.00 31.00 C ATOM 396 O GLU A 25 4.012 -18.199 -26.649 1.00 5.00 O ATOM 397 CB GLU A 25 4.781 -19.829 -29.337 1.00 63.00 C ATOM 398 CG GLU A 25 4.962 -20.079 -30.811 1.00 13.00 C ATOM 399 CD GLU A 25 5.599 -21.408 -31.104 1.00 42.00 C ATOM 400 OE1 GLU A 25 4.920 -22.446 -31.100 1.00 42.00 O ATOM 401 OE2 GLU A 25 6.817 -21.446 -31.339 1.00 73.00 O ATOM 0 H GLU A 25 6.096 -17.869 -27.924 1.00 12.00 H new ATOM 0 HA GLU A 25 3.888 -17.957 -29.845 1.00 32.00 H new ATOM 0 HB2 GLU A 25 5.701 -20.097 -28.817 1.00 63.00 H new ATOM 0 HB3 GLU A 25 3.998 -20.487 -28.960 1.00 63.00 H new ATOM 0 HG2 GLU A 25 3.991 -20.030 -31.305 1.00 13.00 H new ATOM 0 HG3 GLU A 25 5.576 -19.285 -31.236 1.00 13.00 H new ATOM 408 N VAL A 26 2.264 -18.462 -28.020 1.00 32.00 N ATOM 409 CA VAL A 26 1.277 -18.472 -26.972 1.00 63.00 C ATOM 410 C VAL A 26 0.367 -19.661 -27.106 1.00 45.00 C ATOM 411 O VAL A 26 -0.125 -19.965 -28.183 1.00 21.00 O ATOM 412 CB VAL A 26 0.413 -17.172 -26.952 1.00 73.00 C ATOM 413 CG1 VAL A 26 1.248 -15.962 -26.628 1.00 34.00 C ATOM 414 CG2 VAL A 26 -0.330 -16.956 -28.255 1.00 51.00 C ATOM 0 H VAL A 26 1.873 -18.548 -28.958 1.00 32.00 H new ATOM 0 HA VAL A 26 1.829 -18.529 -26.034 1.00 63.00 H new ATOM 0 HB VAL A 26 -0.328 -17.308 -26.164 1.00 73.00 H new ATOM 0 HG11 VAL A 26 0.615 -15.074 -26.622 1.00 34.00 H new ATOM 0 HG12 VAL A 26 1.706 -16.088 -25.647 1.00 34.00 H new ATOM 0 HG13 VAL A 26 2.028 -15.847 -27.380 1.00 34.00 H new ATOM 0 HG21 VAL A 26 -0.917 -16.039 -28.192 1.00 51.00 H new ATOM 0 HG22 VAL A 26 0.386 -16.873 -29.073 1.00 51.00 H new ATOM 0 HG23 VAL A 26 -0.995 -17.800 -28.439 1.00 51.00 H new ATOM 424 N SER A 27 0.205 -20.364 -26.052 1.00 65.00 N ATOM 425 CA SER A 27 -0.791 -21.369 -25.993 1.00 51.00 C ATOM 426 C SER A 27 -1.825 -20.862 -25.036 1.00 43.00 C ATOM 427 O SER A 27 -1.525 -20.609 -23.880 1.00 35.00 O ATOM 428 CB SER A 27 -0.222 -22.709 -25.553 1.00 13.00 C ATOM 429 OG SER A 27 0.837 -23.113 -26.415 1.00 51.00 O ATOM 0 H SER A 27 0.759 -20.261 -25.202 1.00 65.00 H new ATOM 0 HA SER A 27 -1.221 -21.555 -26.977 1.00 51.00 H new ATOM 0 HB2 SER A 27 0.144 -22.636 -24.529 1.00 13.00 H new ATOM 0 HB3 SER A 27 -1.009 -23.463 -25.557 1.00 13.00 H new ATOM 0 HG SER A 27 1.192 -23.976 -26.115 1.00 51.00 H new ATOM 435 N PHE A 28 -2.997 -20.650 -25.506 1.00 73.00 N ATOM 436 CA PHE A 28 -3.986 -20.031 -24.697 1.00 1.00 C ATOM 437 C PHE A 28 -5.157 -20.940 -24.570 1.00 53.00 C ATOM 438 O PHE A 28 -5.379 -21.825 -25.412 1.00 41.00 O ATOM 439 CB PHE A 28 -4.416 -18.661 -25.275 1.00 35.00 C ATOM 440 CG PHE A 28 -5.479 -18.715 -26.367 1.00 11.00 C ATOM 441 CD1 PHE A 28 -5.229 -19.304 -27.592 1.00 31.00 C ATOM 442 CD2 PHE A 28 -6.737 -18.172 -26.142 1.00 74.00 C ATOM 443 CE1 PHE A 28 -6.214 -19.352 -28.568 1.00 73.00 C ATOM 444 CE2 PHE A 28 -7.716 -18.216 -27.111 1.00 61.00 C ATOM 445 CZ PHE A 28 -7.455 -18.808 -28.326 1.00 43.00 C ATOM 0 H PHE A 28 -3.299 -20.895 -26.449 1.00 73.00 H new ATOM 0 HA PHE A 28 -3.562 -19.845 -23.710 1.00 1.00 H new ATOM 0 HB2 PHE A 28 -4.789 -18.043 -24.459 1.00 35.00 H new ATOM 0 HB3 PHE A 28 -3.534 -18.162 -25.675 1.00 35.00 H new ATOM 0 HD1 PHE A 28 -4.257 -19.731 -27.792 1.00 31.00 H new ATOM 0 HD2 PHE A 28 -6.952 -17.707 -25.191 1.00 74.00 H new ATOM 0 HE1 PHE A 28 -6.006 -19.817 -29.520 1.00 73.00 H new ATOM 0 HE2 PHE A 28 -8.688 -17.786 -26.917 1.00 61.00 H new ATOM 0 HZ PHE A 28 -8.221 -18.845 -29.086 1.00 43.00 H new ATOM 455 N VAL A 29 -5.881 -20.740 -23.553 1.00 0.00 N ATOM 456 CA VAL A 29 -7.032 -21.486 -23.311 1.00 31.00 C ATOM 457 C VAL A 29 -8.223 -20.749 -23.897 1.00 21.00 C ATOM 458 O VAL A 29 -8.505 -19.607 -23.564 1.00 73.00 O ATOM 459 CB VAL A 29 -7.207 -21.860 -21.798 1.00 54.00 C ATOM 460 CG1 VAL A 29 -7.386 -20.656 -20.893 1.00 40.00 C ATOM 461 CG2 VAL A 29 -8.309 -22.886 -21.601 1.00 44.00 C ATOM 0 H VAL A 29 -5.683 -20.032 -22.846 1.00 0.00 H new ATOM 0 HA VAL A 29 -6.946 -22.451 -23.810 1.00 31.00 H new ATOM 0 HB VAL A 29 -6.267 -22.318 -21.492 1.00 54.00 H new ATOM 0 HG11 VAL A 29 -7.501 -20.990 -19.862 1.00 40.00 H new ATOM 0 HG12 VAL A 29 -6.511 -20.010 -20.970 1.00 40.00 H new ATOM 0 HG13 VAL A 29 -8.274 -20.102 -21.196 1.00 40.00 H new ATOM 0 HG21 VAL A 29 -8.402 -23.121 -20.541 1.00 44.00 H new ATOM 0 HG22 VAL A 29 -9.253 -22.481 -21.967 1.00 44.00 H new ATOM 0 HG23 VAL A 29 -8.065 -23.793 -22.154 1.00 44.00 H new ATOM 471 N TYR A 30 -8.801 -21.400 -24.864 1.00 51.00 N ATOM 472 CA TYR A 30 -9.995 -20.964 -25.593 1.00 22.00 C ATOM 473 C TYR A 30 -11.069 -20.672 -24.587 1.00 61.00 C ATOM 474 O TYR A 30 -11.664 -19.610 -24.567 1.00 74.00 O ATOM 475 CB TYR A 30 -10.449 -22.155 -26.474 1.00 41.00 C ATOM 476 CG TYR A 30 -11.672 -21.961 -27.375 1.00 64.00 C ATOM 477 CD1 TYR A 30 -12.950 -21.776 -26.850 1.00 0.00 C ATOM 478 CD2 TYR A 30 -11.545 -22.004 -28.749 1.00 41.00 C ATOM 479 CE1 TYR A 30 -14.047 -21.630 -27.664 1.00 5.00 C ATOM 480 CE2 TYR A 30 -12.643 -21.866 -29.568 1.00 53.00 C ATOM 481 CZ TYR A 30 -13.889 -21.678 -29.023 1.00 43.00 C ATOM 482 OH TYR A 30 -14.985 -21.538 -29.852 1.00 51.00 O ATOM 0 H TYR A 30 -8.448 -22.298 -25.196 1.00 51.00 H new ATOM 0 HA TYR A 30 -9.798 -20.081 -26.201 1.00 22.00 H new ATOM 0 HB2 TYR A 30 -9.609 -22.440 -27.108 1.00 41.00 H new ATOM 0 HB3 TYR A 30 -10.651 -22.999 -25.815 1.00 41.00 H new ATOM 0 HD1 TYR A 30 -13.081 -21.747 -25.778 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -10.569 -22.148 -29.188 1.00 41.00 H new ATOM 0 HE1 TYR A 30 -15.027 -21.479 -27.235 1.00 5.00 H new ATOM 0 HE2 TYR A 30 -12.524 -21.906 -30.641 1.00 53.00 H new ATOM 0 HH TYR A 30 -14.697 -21.595 -30.787 1.00 51.00 H new ATOM 492 N ASP A 31 -11.274 -21.662 -23.761 1.00 33.00 N ATOM 493 CA ASP A 31 -12.267 -21.673 -22.728 1.00 54.00 C ATOM 494 C ASP A 31 -12.049 -22.922 -21.922 1.00 43.00 C ATOM 495 O ASP A 31 -11.905 -22.880 -20.701 1.00 62.00 O ATOM 496 CB ASP A 31 -13.686 -21.675 -23.327 1.00 14.00 C ATOM 497 CG ASP A 31 -14.787 -21.771 -22.294 1.00 2.00 C ATOM 498 OD1 ASP A 31 -15.202 -22.898 -21.970 1.00 34.00 O ATOM 499 OD2 ASP A 31 -15.278 -20.721 -21.820 1.00 64.00 O ATOM 0 H ASP A 31 -10.726 -22.522 -23.794 1.00 33.00 H new ATOM 0 HA ASP A 31 -12.177 -20.781 -22.108 1.00 54.00 H new ATOM 0 HB2 ASP A 31 -13.825 -20.764 -23.909 1.00 14.00 H new ATOM 0 HB3 ASP A 31 -13.776 -22.512 -24.019 1.00 14.00 H new ATOM 504 N ASN A 32 -11.963 -24.043 -22.620 1.00 51.00 N ATOM 505 CA ASN A 32 -11.765 -25.328 -21.971 1.00 41.00 C ATOM 506 C ASN A 32 -10.742 -26.191 -22.759 1.00 12.00 C ATOM 507 O ASN A 32 -10.571 -27.375 -22.493 1.00 41.00 O ATOM 508 CB ASN A 32 -13.147 -26.034 -21.834 1.00 22.00 C ATOM 509 CG ASN A 32 -13.146 -27.310 -20.991 1.00 73.00 C ATOM 510 OD1 ASN A 32 -12.985 -28.421 -21.508 1.00 0.00 O ATOM 511 ND2 ASN A 32 -13.348 -27.168 -19.703 1.00 51.00 N ATOM 0 H ASN A 32 -12.027 -24.089 -23.637 1.00 51.00 H new ATOM 0 HA ASN A 32 -11.346 -25.185 -20.975 1.00 41.00 H new ATOM 0 HB2 ASN A 32 -13.855 -25.330 -21.397 1.00 22.00 H new ATOM 0 HB3 ASN A 32 -13.513 -26.277 -22.831 1.00 22.00 H new ATOM 0 HD21 ASN A 32 -13.376 -27.988 -19.098 1.00 51.00 H new ATOM 0 HD22 ASN A 32 -13.477 -26.237 -19.307 1.00 51.00 H new ATOM 518 N GLN A 33 -9.996 -25.569 -23.670 1.00 15.00 N ATOM 519 CA GLN A 33 -9.030 -26.273 -24.477 1.00 71.00 C ATOM 520 C GLN A 33 -7.956 -25.307 -24.803 1.00 5.00 C ATOM 521 O GLN A 33 -8.188 -24.094 -24.771 1.00 0.00 O ATOM 522 CB GLN A 33 -9.647 -26.844 -25.759 1.00 53.00 C ATOM 523 CG GLN A 33 -10.159 -25.795 -26.716 1.00 4.00 C ATOM 524 CD GLN A 33 -10.792 -26.377 -27.968 1.00 44.00 C ATOM 525 OE1 GLN A 33 -11.343 -27.474 -27.951 1.00 11.00 O ATOM 526 NE2 GLN A 33 -10.732 -25.652 -29.051 1.00 15.00 N ATOM 0 H GLN A 33 -10.051 -24.569 -23.861 1.00 15.00 H new ATOM 0 HA GLN A 33 -8.643 -27.129 -23.923 1.00 71.00 H new ATOM 0 HB2 GLN A 33 -8.900 -27.453 -26.269 1.00 53.00 H new ATOM 0 HB3 GLN A 33 -10.469 -27.507 -25.490 1.00 53.00 H new ATOM 0 HG2 GLN A 33 -10.892 -25.173 -26.203 1.00 4.00 H new ATOM 0 HG3 GLN A 33 -9.334 -25.143 -27.004 1.00 4.00 H new ATOM 0 HE21 GLN A 33 -10.267 -24.744 -29.032 1.00 15.00 H new ATOM 0 HE22 GLN A 33 -11.150 -25.993 -29.917 1.00 15.00 H new ATOM 535 N LEU A 34 -6.825 -25.801 -25.100 1.00 55.00 N ATOM 536 CA LEU A 34 -5.690 -24.977 -25.341 1.00 23.00 C ATOM 537 C LEU A 34 -5.360 -24.972 -26.824 1.00 75.00 C ATOM 538 O LEU A 34 -5.374 -26.020 -27.470 1.00 41.00 O ATOM 539 CB LEU A 34 -4.458 -25.478 -24.540 1.00 2.00 C ATOM 540 CG LEU A 34 -4.394 -25.256 -23.001 1.00 74.00 C ATOM 541 CD1 LEU A 34 -4.322 -23.792 -22.651 1.00 53.00 C ATOM 542 CD2 LEU A 34 -5.534 -25.944 -22.256 1.00 42.00 C ATOM 0 H LEU A 34 -6.646 -26.801 -25.187 1.00 55.00 H new ATOM 0 HA LEU A 34 -5.930 -23.965 -25.014 1.00 23.00 H new ATOM 0 HB2 LEU A 34 -4.368 -26.550 -24.718 1.00 2.00 H new ATOM 0 HB3 LEU A 34 -3.575 -25.008 -24.973 1.00 2.00 H new ATOM 0 HG LEU A 34 -3.470 -25.728 -22.666 1.00 74.00 H new ATOM 0 HD11 LEU A 34 -4.279 -23.679 -21.568 1.00 53.00 H new ATOM 0 HD12 LEU A 34 -3.429 -23.355 -23.098 1.00 53.00 H new ATOM 0 HD13 LEU A 34 -5.206 -23.282 -23.034 1.00 53.00 H new ATOM 0 HD21 LEU A 34 -5.437 -25.754 -21.187 1.00 42.00 H new ATOM 0 HD22 LEU A 34 -6.488 -25.552 -22.609 1.00 42.00 H new ATOM 0 HD23 LEU A 34 -5.493 -27.018 -22.439 1.00 42.00 H new ATOM 554 N LEU A 35 -5.120 -23.809 -27.359 1.00 23.00 N ATOM 555 CA LEU A 35 -4.670 -23.660 -28.728 1.00 14.00 C ATOM 556 C LEU A 35 -3.355 -22.959 -28.702 1.00 74.00 C ATOM 557 O LEU A 35 -2.947 -22.474 -27.661 1.00 53.00 O ATOM 558 CB LEU A 35 -5.630 -22.846 -29.597 1.00 53.00 C ATOM 559 CG LEU A 35 -7.013 -23.414 -29.880 1.00 34.00 C ATOM 560 CD1 LEU A 35 -6.959 -24.846 -30.400 1.00 24.00 C ATOM 561 CD2 LEU A 35 -7.950 -23.265 -28.706 1.00 13.00 C ATOM 0 H LEU A 35 -5.230 -22.926 -26.860 1.00 23.00 H new ATOM 0 HA LEU A 35 -4.608 -24.657 -29.165 1.00 14.00 H new ATOM 0 HB2 LEU A 35 -5.762 -21.873 -29.123 1.00 53.00 H new ATOM 0 HB3 LEU A 35 -5.141 -22.670 -30.555 1.00 53.00 H new ATOM 0 HG LEU A 35 -7.431 -22.810 -30.685 1.00 34.00 H new ATOM 0 HD11 LEU A 35 -7.972 -25.204 -30.586 1.00 24.00 H new ATOM 0 HD12 LEU A 35 -6.388 -24.875 -31.328 1.00 24.00 H new ATOM 0 HD13 LEU A 35 -6.479 -25.485 -29.658 1.00 24.00 H new ATOM 0 HD21 LEU A 35 -8.922 -23.686 -28.961 1.00 13.00 H new ATOM 0 HD22 LEU A 35 -7.541 -23.793 -27.844 1.00 13.00 H new ATOM 0 HD23 LEU A 35 -8.065 -22.208 -28.464 1.00 13.00 H new ATOM 573 N HIS A 36 -2.725 -22.845 -29.830 1.00 22.00 N ATOM 574 CA HIS A 36 -1.406 -22.239 -29.887 1.00 51.00 C ATOM 575 C HIS A 36 -1.212 -21.344 -31.092 1.00 21.00 C ATOM 576 O HIS A 36 -1.592 -21.684 -32.214 1.00 2.00 O ATOM 577 CB HIS A 36 -0.274 -23.279 -29.735 1.00 42.00 C ATOM 578 CG HIS A 36 -0.245 -24.417 -30.734 1.00 11.00 C ATOM 579 ND1 HIS A 36 0.869 -25.206 -30.862 1.00 0.00 N ATOM 580 CD2 HIS A 36 -1.212 -24.886 -31.562 1.00 1.00 C ATOM 581 CE1 HIS A 36 0.549 -26.133 -31.756 1.00 3.00 C ATOM 582 NE2 HIS A 36 -0.696 -25.974 -32.201 1.00 74.00 N ATOM 0 H HIS A 36 -3.091 -23.159 -30.729 1.00 22.00 H new ATOM 0 HA HIS A 36 -1.344 -21.582 -29.020 1.00 51.00 H new ATOM 0 HB2 HIS A 36 0.679 -22.753 -29.793 1.00 42.00 H new ATOM 0 HB3 HIS A 36 -0.341 -23.708 -28.735 1.00 42.00 H new ATOM 0 HD2 HIS A 36 -2.203 -24.475 -31.690 1.00 1.00 H new ATOM 0 HE1 HIS A 36 1.215 -26.918 -32.082 1.00 3.00 H new ATOM 0 HE2 HIS A 36 -1.173 -26.556 -32.890 1.00 74.00 H new ATOM 590 N LEU A 37 -0.645 -20.193 -30.839 1.00 44.00 N ATOM 591 CA LEU A 37 -0.404 -19.173 -31.843 1.00 53.00 C ATOM 592 C LEU A 37 0.997 -18.693 -31.708 1.00 41.00 C ATOM 593 O LEU A 37 1.650 -18.949 -30.703 1.00 3.00 O ATOM 594 CB LEU A 37 -1.308 -17.953 -31.653 1.00 74.00 C ATOM 595 CG LEU A 37 -2.821 -18.129 -31.669 1.00 23.00 C ATOM 596 CD1 LEU A 37 -3.300 -18.966 -32.848 1.00 74.00 C ATOM 597 CD2 LEU A 37 -3.337 -18.634 -30.338 1.00 73.00 C ATOM 0 H LEU A 37 -0.328 -19.926 -29.907 1.00 44.00 H new ATOM 0 HA LEU A 37 -0.603 -19.621 -32.817 1.00 53.00 H new ATOM 0 HB2 LEU A 37 -1.043 -17.496 -30.700 1.00 74.00 H new ATOM 0 HB3 LEU A 37 -1.055 -17.235 -32.433 1.00 74.00 H new ATOM 0 HG LEU A 37 -3.256 -17.141 -31.818 1.00 23.00 H new ATOM 0 HD11 LEU A 37 -4.385 -19.060 -32.811 1.00 74.00 H new ATOM 0 HD12 LEU A 37 -3.010 -18.481 -33.780 1.00 74.00 H new ATOM 0 HD13 LEU A 37 -2.848 -19.957 -32.798 1.00 74.00 H new ATOM 0 HD21 LEU A 37 -4.420 -18.747 -30.387 1.00 73.00 H new ATOM 0 HD22 LEU A 37 -2.881 -19.598 -30.113 1.00 73.00 H new ATOM 0 HD23 LEU A 37 -3.082 -17.920 -29.554 1.00 73.00 H new ATOM 609 N LYS A 38 1.432 -17.953 -32.673 1.00 63.00 N ATOM 610 CA LYS A 38 2.761 -17.437 -32.693 1.00 62.00 C ATOM 611 C LYS A 38 2.750 -16.020 -33.204 1.00 53.00 C ATOM 612 O LYS A 38 1.888 -15.650 -33.988 1.00 44.00 O ATOM 613 CB LYS A 38 3.618 -18.282 -33.599 1.00 20.00 C ATOM 614 CG LYS A 38 3.122 -18.340 -35.024 1.00 53.00 C ATOM 615 CD LYS A 38 4.137 -18.978 -35.897 1.00 63.00 C ATOM 616 CE LYS A 38 3.679 -18.993 -37.351 1.00 75.00 C ATOM 617 NZ LYS A 38 4.660 -19.633 -38.246 1.00 11.00 N ATOM 0 H LYS A 38 0.868 -17.686 -33.480 1.00 63.00 H new ATOM 0 HA LYS A 38 3.166 -17.456 -31.681 1.00 62.00 H new ATOM 0 HB2 LYS A 38 4.635 -17.889 -33.593 1.00 20.00 H new ATOM 0 HB3 LYS A 38 3.666 -19.295 -33.199 1.00 20.00 H new ATOM 0 HG2 LYS A 38 2.189 -18.902 -35.069 1.00 53.00 H new ATOM 0 HG3 LYS A 38 2.905 -17.334 -35.382 1.00 53.00 H new ATOM 0 HD2 LYS A 38 5.081 -18.440 -35.815 1.00 63.00 H new ATOM 0 HD3 LYS A 38 4.321 -19.998 -35.560 1.00 63.00 H new ATOM 0 HE2 LYS A 38 2.728 -19.521 -37.423 1.00 75.00 H new ATOM 0 HE3 LYS A 38 3.502 -17.970 -37.683 1.00 75.00 H new ATOM 0 HZ1 LYS A 38 4.301 -19.617 -39.222 1.00 11.00 H new ATOM 0 HZ2 LYS A 38 5.561 -19.116 -38.200 1.00 11.00 H new ATOM 0 HZ3 LYS A 38 4.811 -20.618 -37.948 1.00 11.00 H new ATOM 631 N GLN A 39 3.688 -15.253 -32.789 1.00 61.00 N ATOM 632 CA GLN A 39 3.775 -13.873 -33.234 1.00 44.00 C ATOM 633 C GLN A 39 4.578 -13.828 -34.500 1.00 63.00 C ATOM 634 O GLN A 39 5.816 -13.888 -34.485 1.00 15.00 O ATOM 635 CB GLN A 39 4.395 -12.996 -32.182 1.00 50.00 C ATOM 636 CG GLN A 39 4.450 -11.522 -32.549 1.00 30.00 C ATOM 637 CD GLN A 39 5.118 -10.682 -31.486 1.00 3.00 C ATOM 638 OE1 GLN A 39 5.984 -11.149 -30.757 1.00 61.00 O ATOM 639 NE2 GLN A 39 4.762 -9.437 -31.412 1.00 52.00 N ATOM 0 H GLN A 39 4.420 -15.539 -32.139 1.00 61.00 H new ATOM 0 HA GLN A 39 2.770 -13.492 -33.417 1.00 44.00 H new ATOM 0 HB2 GLN A 39 3.832 -13.107 -31.255 1.00 50.00 H new ATOM 0 HB3 GLN A 39 5.408 -13.347 -31.984 1.00 50.00 H new ATOM 0 HG2 GLN A 39 4.988 -11.406 -33.490 1.00 30.00 H new ATOM 0 HG3 GLN A 39 3.437 -11.155 -32.714 1.00 30.00 H new ATOM 0 HE21 GLN A 39 4.037 -9.076 -32.033 1.00 52.00 H new ATOM 0 HE22 GLN A 39 5.207 -8.819 -30.733 1.00 52.00 H new ATOM 648 N GLY A 40 3.881 -13.786 -35.574 1.00 74.00 N ATOM 649 CA GLY A 40 4.505 -13.802 -36.867 1.00 11.00 C ATOM 650 C GLY A 40 4.285 -12.524 -37.602 1.00 11.00 C ATOM 651 O GLY A 40 5.233 -11.822 -37.943 1.00 41.00 O ATOM 0 H GLY A 40 2.862 -13.739 -35.594 1.00 74.00 H new ATOM 0 HA2 GLY A 40 5.575 -13.976 -36.752 1.00 11.00 H new ATOM 0 HA3 GLY A 40 4.108 -14.631 -37.452 1.00 11.00 H new ATOM 655 N ILE A 41 3.040 -12.195 -37.809 1.00 11.00 N ATOM 656 CA ILE A 41 2.672 -11.002 -38.531 1.00 73.00 C ATOM 657 C ILE A 41 1.847 -10.126 -37.626 1.00 33.00 C ATOM 658 O ILE A 41 0.775 -10.521 -37.197 1.00 22.00 O ATOM 659 CB ILE A 41 1.829 -11.346 -39.772 1.00 65.00 C ATOM 660 CG1 ILE A 41 2.590 -12.328 -40.671 1.00 21.00 C ATOM 661 CG2 ILE A 41 1.485 -10.063 -40.536 1.00 14.00 C ATOM 662 CD1 ILE A 41 1.756 -12.925 -41.771 1.00 33.00 C ATOM 0 H ILE A 41 2.247 -12.747 -37.482 1.00 11.00 H new ATOM 0 HA ILE A 41 3.582 -10.494 -38.851 1.00 73.00 H new ATOM 0 HB ILE A 41 0.901 -11.822 -39.456 1.00 65.00 H new ATOM 0 HG12 ILE A 41 3.442 -11.813 -41.114 1.00 21.00 H new ATOM 0 HG13 ILE A 41 2.990 -13.133 -40.055 1.00 21.00 H new ATOM 0 HG21 ILE A 41 0.888 -10.311 -41.414 1.00 14.00 H new ATOM 0 HG22 ILE A 41 0.917 -9.395 -39.888 1.00 14.00 H new ATOM 0 HG23 ILE A 41 2.404 -9.569 -40.850 1.00 14.00 H new ATOM 0 HD11 ILE A 41 2.367 -13.608 -42.361 1.00 33.00 H new ATOM 0 HD12 ILE A 41 0.918 -13.471 -41.337 1.00 33.00 H new ATOM 0 HD13 ILE A 41 1.377 -12.130 -42.413 1.00 33.00 H new ATOM 674 N SER A 42 2.334 -8.970 -37.339 1.00 13.00 N ATOM 675 CA SER A 42 1.655 -8.064 -36.484 1.00 71.00 C ATOM 676 C SER A 42 1.305 -6.780 -37.224 1.00 30.00 C ATOM 677 O SER A 42 2.175 -5.949 -37.510 1.00 33.00 O ATOM 678 CB SER A 42 2.513 -7.786 -35.275 1.00 22.00 C ATOM 679 OG SER A 42 2.742 -8.983 -34.524 1.00 52.00 O ATOM 0 H SER A 42 3.225 -8.624 -37.696 1.00 13.00 H new ATOM 0 HA SER A 42 0.717 -8.510 -36.155 1.00 71.00 H new ATOM 0 HB2 SER A 42 3.466 -7.362 -35.591 1.00 22.00 H new ATOM 0 HB3 SER A 42 2.027 -7.043 -34.643 1.00 22.00 H new ATOM 0 HG SER A 42 3.530 -8.866 -33.954 1.00 52.00 H new ATOM 685 N ALA A 43 0.042 -6.655 -37.585 1.00 74.00 N ATOM 686 CA ALA A 43 -0.440 -5.507 -38.266 1.00 73.00 C ATOM 687 C ALA A 43 -0.671 -4.335 -37.319 1.00 73.00 C ATOM 688 O ALA A 43 0.151 -3.424 -37.222 1.00 5.00 O ATOM 689 CB ALA A 43 -1.703 -5.827 -39.049 1.00 75.00 C ATOM 0 H ALA A 43 -0.670 -7.363 -37.404 1.00 74.00 H new ATOM 0 HA ALA A 43 0.334 -5.205 -38.972 1.00 73.00 H new ATOM 0 HB1 ALA A 43 -2.051 -4.930 -39.561 1.00 75.00 H new ATOM 0 HB2 ALA A 43 -1.489 -6.604 -39.783 1.00 75.00 H new ATOM 0 HB3 ALA A 43 -2.476 -6.177 -38.365 1.00 75.00 H new ATOM 695 N SER A 44 -1.762 -4.384 -36.603 1.00 22.00 N ATOM 696 CA SER A 44 -2.173 -3.326 -35.724 1.00 60.00 C ATOM 697 C SER A 44 -1.808 -3.614 -34.260 1.00 42.00 C ATOM 698 O SER A 44 -2.443 -3.100 -33.337 1.00 3.00 O ATOM 699 CB SER A 44 -3.676 -3.188 -35.892 1.00 23.00 C ATOM 700 OG SER A 44 -4.278 -4.481 -35.901 1.00 75.00 O ATOM 0 H SER A 44 -2.402 -5.178 -36.616 1.00 22.00 H new ATOM 0 HA SER A 44 -1.656 -2.401 -35.979 1.00 60.00 H new ATOM 0 HB2 SER A 44 -4.089 -2.589 -35.080 1.00 23.00 H new ATOM 0 HB3 SER A 44 -3.902 -2.664 -36.821 1.00 23.00 H new ATOM 0 HG SER A 44 -4.272 -4.851 -34.993 1.00 75.00 H new ATOM 706 N GLY A 45 -0.785 -4.396 -34.038 1.00 52.00 N ATOM 707 CA GLY A 45 -0.422 -4.736 -32.685 1.00 24.00 C ATOM 708 C GLY A 45 0.624 -5.786 -32.655 1.00 13.00 C ATOM 709 O GLY A 45 1.677 -5.641 -33.259 1.00 55.00 O ATOM 0 H GLY A 45 -0.195 -4.805 -34.763 1.00 52.00 H new ATOM 0 HA2 GLY A 45 -0.062 -3.846 -32.168 1.00 24.00 H new ATOM 0 HA3 GLY A 45 -1.304 -5.083 -32.146 1.00 24.00 H new ATOM 713 N ALA A 46 0.309 -6.850 -32.014 1.00 71.00 N ATOM 714 CA ALA A 46 1.147 -7.951 -31.859 1.00 65.00 C ATOM 715 C ALA A 46 0.245 -9.079 -32.078 1.00 20.00 C ATOM 716 O ALA A 46 -0.740 -9.235 -31.348 1.00 32.00 O ATOM 717 CB ALA A 46 1.707 -7.970 -30.461 1.00 13.00 C ATOM 0 H ALA A 46 -0.597 -6.970 -31.562 1.00 71.00 H new ATOM 0 HA ALA A 46 2.004 -7.957 -32.533 1.00 65.00 H new ATOM 0 HB1 ALA A 46 2.362 -8.833 -30.343 1.00 13.00 H new ATOM 0 HB2 ALA A 46 2.275 -7.056 -30.284 1.00 13.00 H new ATOM 0 HB3 ALA A 46 0.890 -8.034 -29.743 1.00 13.00 H new ATOM 723 N ARG A 47 0.474 -9.811 -33.090 1.00 23.00 N ATOM 724 CA ARG A 47 -0.449 -10.797 -33.406 1.00 5.00 C ATOM 725 C ARG A 47 0.134 -12.138 -33.264 1.00 2.00 C ATOM 726 O ARG A 47 1.110 -12.488 -33.937 1.00 35.00 O ATOM 727 CB ARG A 47 -1.033 -10.649 -34.793 1.00 21.00 C ATOM 728 CG ARG A 47 -1.969 -9.482 -34.993 1.00 1.00 C ATOM 729 CD ARG A 47 -2.472 -9.466 -36.422 1.00 31.00 C ATOM 730 NE ARG A 47 -3.062 -10.760 -36.807 1.00 11.00 N ATOM 731 CZ ARG A 47 -3.360 -11.144 -38.065 1.00 33.00 C ATOM 732 NH1 ARG A 47 -3.190 -10.314 -39.093 1.00 72.00 N ATOM 733 NH2 ARG A 47 -3.833 -12.358 -38.278 1.00 41.00 N ATOM 0 H ARG A 47 1.286 -9.743 -33.704 1.00 23.00 H new ATOM 0 HA ARG A 47 -1.263 -10.672 -32.692 1.00 5.00 H new ATOM 0 HB2 ARG A 47 -0.212 -10.557 -35.504 1.00 21.00 H new ATOM 0 HB3 ARG A 47 -1.568 -11.566 -35.041 1.00 21.00 H new ATOM 0 HG2 ARG A 47 -2.809 -9.556 -34.303 1.00 1.00 H new ATOM 0 HG3 ARG A 47 -1.454 -8.548 -34.769 1.00 1.00 H new ATOM 0 HD2 ARG A 47 -3.216 -8.678 -36.537 1.00 31.00 H new ATOM 0 HD3 ARG A 47 -1.649 -9.227 -37.095 1.00 31.00 H new ATOM 0 HE ARG A 47 -3.262 -11.422 -36.058 1.00 11.00 H new ATOM 0 HH11 ARG A 47 -2.830 -9.373 -38.935 1.00 72.00 H new ATOM 0 HH12 ARG A 47 -3.420 -10.620 -40.039 1.00 72.00 H new ATOM 0 HH21 ARG A 47 -3.970 -12.997 -37.495 1.00 41.00 H new ATOM 0 HH22 ARG A 47 -4.061 -12.657 -39.226 1.00 41.00 H new ATOM 747 N TYR A 48 -0.439 -12.872 -32.407 1.00 33.00 N ATOM 748 CA TYR A 48 -0.111 -14.208 -32.241 1.00 61.00 C ATOM 749 C TYR A 48 -1.167 -14.941 -33.011 1.00 20.00 C ATOM 750 O TYR A 48 -2.333 -14.951 -32.648 1.00 22.00 O ATOM 751 CB TYR A 48 -0.084 -14.589 -30.765 1.00 34.00 C ATOM 752 CG TYR A 48 0.977 -13.861 -29.937 1.00 24.00 C ATOM 753 CD1 TYR A 48 0.738 -12.595 -29.399 1.00 3.00 C ATOM 754 CD2 TYR A 48 2.211 -14.452 -29.683 1.00 12.00 C ATOM 755 CE1 TYR A 48 1.695 -11.945 -28.639 1.00 35.00 C ATOM 756 CE2 TYR A 48 3.173 -13.806 -28.923 1.00 22.00 C ATOM 757 CZ TYR A 48 2.910 -12.553 -28.403 1.00 21.00 C ATOM 758 OH TYR A 48 3.872 -11.907 -27.648 1.00 55.00 O ATOM 0 H TYR A 48 -1.175 -12.542 -31.782 1.00 33.00 H new ATOM 0 HA TYR A 48 0.888 -14.451 -32.603 1.00 61.00 H new ATOM 0 HB2 TYR A 48 -1.064 -14.387 -30.333 1.00 34.00 H new ATOM 0 HB3 TYR A 48 0.085 -15.663 -30.684 1.00 34.00 H new ATOM 0 HD1 TYR A 48 -0.212 -12.114 -29.579 1.00 3.00 H new ATOM 0 HD2 TYR A 48 2.423 -15.432 -30.085 1.00 12.00 H new ATOM 0 HE1 TYR A 48 1.491 -10.965 -28.232 1.00 35.00 H new ATOM 0 HE2 TYR A 48 4.125 -14.280 -28.738 1.00 22.00 H new ATOM 0 HH TYR A 48 4.668 -12.474 -27.577 1.00 55.00 H new ATOM 768 N THR A 49 -0.796 -15.464 -34.113 1.00 43.00 N ATOM 769 CA THR A 49 -1.715 -16.050 -35.016 1.00 4.00 C ATOM 770 C THR A 49 -0.964 -17.053 -35.870 1.00 52.00 C ATOM 771 O THR A 49 0.243 -16.936 -36.041 1.00 25.00 O ATOM 772 CB THR A 49 -2.351 -14.958 -35.956 1.00 24.00 C ATOM 773 OG1 THR A 49 -3.009 -13.937 -35.174 1.00 53.00 O ATOM 774 CG2 THR A 49 -3.358 -15.574 -36.937 1.00 22.00 C ATOM 0 H THR A 49 0.175 -15.500 -34.424 1.00 43.00 H new ATOM 0 HA THR A 49 -2.514 -16.531 -34.453 1.00 4.00 H new ATOM 0 HB THR A 49 -1.538 -14.512 -36.529 1.00 24.00 H new ATOM 0 HG1 THR A 49 -2.337 -13.402 -34.702 1.00 53.00 H new ATOM 0 HG21 THR A 49 -3.776 -14.791 -37.569 1.00 22.00 H new ATOM 0 HG22 THR A 49 -2.854 -16.313 -37.560 1.00 22.00 H new ATOM 0 HG23 THR A 49 -4.160 -16.057 -36.379 1.00 22.00 H new ATOM 782 N ASP A 50 -1.658 -18.033 -36.337 1.00 64.00 N ATOM 783 CA ASP A 50 -1.127 -18.984 -37.270 1.00 14.00 C ATOM 784 C ASP A 50 -2.237 -19.293 -38.256 1.00 2.00 C ATOM 785 O ASP A 50 -2.285 -18.744 -39.355 1.00 61.00 O ATOM 786 CB ASP A 50 -0.635 -20.248 -36.547 1.00 41.00 C ATOM 787 CG ASP A 50 -0.087 -21.289 -37.493 1.00 23.00 C ATOM 788 OD1 ASP A 50 1.088 -21.214 -37.861 1.00 75.00 O ATOM 789 OD2 ASP A 50 -0.845 -22.211 -37.863 1.00 54.00 O ATOM 0 H ASP A 50 -2.630 -18.205 -36.080 1.00 64.00 H new ATOM 0 HA ASP A 50 -0.259 -18.581 -37.792 1.00 14.00 H new ATOM 0 HB2 ASP A 50 0.138 -19.973 -35.830 1.00 41.00 H new ATOM 0 HB3 ASP A 50 -1.459 -20.679 -35.978 1.00 41.00 H new ATOM 794 N GLY A 51 -3.186 -20.075 -37.807 1.00 61.00 N ATOM 795 CA GLY A 51 -4.346 -20.383 -38.625 1.00 65.00 C ATOM 796 C GLY A 51 -5.575 -20.735 -37.799 1.00 34.00 C ATOM 797 O GLY A 51 -6.677 -20.869 -38.332 1.00 54.00 O ATOM 0 H GLY A 51 -3.185 -20.511 -36.885 1.00 61.00 H new ATOM 0 HA2 GLY A 51 -4.574 -19.527 -39.260 1.00 65.00 H new ATOM 0 HA3 GLY A 51 -4.108 -21.216 -39.286 1.00 65.00 H new ATOM 801 N ILE A 52 -5.411 -20.825 -36.493 1.00 4.00 N ATOM 802 CA ILE A 52 -6.489 -21.247 -35.626 1.00 35.00 C ATOM 803 C ILE A 52 -7.387 -20.048 -35.324 1.00 74.00 C ATOM 804 O ILE A 52 -8.530 -20.004 -35.720 1.00 24.00 O ATOM 805 CB ILE A 52 -5.936 -21.852 -34.305 1.00 32.00 C ATOM 806 CG1 ILE A 52 -4.846 -22.897 -34.609 1.00 13.00 C ATOM 807 CG2 ILE A 52 -7.065 -22.505 -33.524 1.00 34.00 C ATOM 808 CD1 ILE A 52 -4.211 -23.514 -33.376 1.00 10.00 C ATOM 0 H ILE A 52 -4.538 -20.610 -36.010 1.00 4.00 H new ATOM 0 HA ILE A 52 -7.067 -22.021 -36.130 1.00 35.00 H new ATOM 0 HB ILE A 52 -5.500 -21.050 -33.710 1.00 32.00 H new ATOM 0 HG12 ILE A 52 -5.280 -23.692 -35.216 1.00 13.00 H new ATOM 0 HG13 ILE A 52 -4.066 -22.428 -35.209 1.00 13.00 H new ATOM 0 HG21 ILE A 52 -6.671 -22.927 -32.599 1.00 34.00 H new ATOM 0 HG22 ILE A 52 -7.823 -21.759 -33.288 1.00 34.00 H new ATOM 0 HG23 ILE A 52 -7.511 -23.298 -34.124 1.00 34.00 H new ATOM 0 HD11 ILE A 52 -3.455 -24.238 -33.680 1.00 10.00 H new ATOM 0 HD12 ILE A 52 -3.744 -22.732 -32.777 1.00 10.00 H new ATOM 0 HD13 ILE A 52 -4.977 -24.016 -32.785 1.00 10.00 H new ATOM 820 N TYR A 53 -6.833 -19.070 -34.661 1.00 13.00 N ATOM 821 CA TYR A 53 -7.508 -17.826 -34.339 1.00 20.00 C ATOM 822 C TYR A 53 -6.503 -16.747 -34.441 1.00 72.00 C ATOM 823 O TYR A 53 -5.309 -17.024 -34.624 1.00 4.00 O ATOM 824 CB TYR A 53 -8.085 -17.840 -32.921 1.00 52.00 C ATOM 825 CG TYR A 53 -9.189 -18.848 -32.758 1.00 42.00 C ATOM 826 CD1 TYR A 53 -10.424 -18.610 -33.308 1.00 12.00 C ATOM 827 CD2 TYR A 53 -8.978 -20.058 -32.122 1.00 75.00 C ATOM 828 CE1 TYR A 53 -11.422 -19.539 -33.247 1.00 13.00 C ATOM 829 CE2 TYR A 53 -9.986 -20.997 -32.041 1.00 63.00 C ATOM 830 CZ TYR A 53 -11.207 -20.727 -32.618 1.00 11.00 C ATOM 831 OH TYR A 53 -12.213 -21.664 -32.590 1.00 64.00 O ATOM 0 H TYR A 53 -5.874 -19.110 -34.317 1.00 13.00 H new ATOM 0 HA TYR A 53 -8.340 -17.678 -35.027 1.00 20.00 H new ATOM 0 HB2 TYR A 53 -7.288 -18.060 -32.210 1.00 52.00 H new ATOM 0 HB3 TYR A 53 -8.464 -16.848 -32.677 1.00 52.00 H new ATOM 0 HD1 TYR A 53 -10.610 -17.667 -33.800 1.00 12.00 H new ATOM 0 HD2 TYR A 53 -8.014 -20.270 -31.684 1.00 75.00 H new ATOM 0 HE1 TYR A 53 -12.381 -19.332 -33.697 1.00 13.00 H new ATOM 0 HE2 TYR A 53 -9.819 -21.934 -31.530 1.00 63.00 H new ATOM 0 HH TYR A 53 -11.864 -22.508 -32.235 1.00 64.00 H new ATOM 841 N VAL A 54 -6.950 -15.561 -34.333 1.00 12.00 N ATOM 842 CA VAL A 54 -6.119 -14.416 -34.422 1.00 74.00 C ATOM 843 C VAL A 54 -6.060 -13.756 -33.070 1.00 25.00 C ATOM 844 O VAL A 54 -7.004 -13.098 -32.664 1.00 15.00 O ATOM 845 CB VAL A 54 -6.701 -13.449 -35.463 1.00 33.00 C ATOM 846 CG1 VAL A 54 -5.985 -12.097 -35.467 1.00 71.00 C ATOM 847 CG2 VAL A 54 -6.648 -14.074 -36.855 1.00 73.00 C ATOM 0 H VAL A 54 -7.934 -15.345 -34.175 1.00 12.00 H new ATOM 0 HA VAL A 54 -5.112 -14.699 -34.729 1.00 74.00 H new ATOM 0 HB VAL A 54 -7.739 -13.266 -35.185 1.00 33.00 H new ATOM 0 HG11 VAL A 54 -6.434 -11.450 -36.220 1.00 71.00 H new ATOM 0 HG12 VAL A 54 -6.080 -11.632 -34.486 1.00 71.00 H new ATOM 0 HG13 VAL A 54 -4.930 -12.245 -35.698 1.00 71.00 H new ATOM 0 HG21 VAL A 54 -7.064 -13.377 -37.583 1.00 73.00 H new ATOM 0 HG22 VAL A 54 -5.613 -14.296 -37.115 1.00 73.00 H new ATOM 0 HG23 VAL A 54 -7.229 -14.996 -36.862 1.00 73.00 H new ATOM 857 N PHE A 55 -4.999 -13.990 -32.359 1.00 3.00 N ATOM 858 CA PHE A 55 -4.824 -13.400 -31.058 1.00 30.00 C ATOM 859 C PHE A 55 -4.116 -12.077 -31.251 1.00 73.00 C ATOM 860 O PHE A 55 -2.919 -12.029 -31.551 1.00 3.00 O ATOM 861 CB PHE A 55 -4.027 -14.351 -30.135 1.00 4.00 C ATOM 862 CG PHE A 55 -3.836 -13.874 -28.715 1.00 34.00 C ATOM 863 CD1 PHE A 55 -2.785 -13.032 -28.379 1.00 10.00 C ATOM 864 CD2 PHE A 55 -4.695 -14.289 -27.716 1.00 1.00 C ATOM 865 CE1 PHE A 55 -2.602 -12.609 -27.079 1.00 44.00 C ATOM 866 CE2 PHE A 55 -4.520 -13.868 -26.415 1.00 44.00 C ATOM 867 CZ PHE A 55 -3.471 -13.028 -26.094 1.00 55.00 C ATOM 0 H PHE A 55 -4.231 -14.591 -32.658 1.00 3.00 H new ATOM 0 HA PHE A 55 -5.786 -13.232 -30.573 1.00 30.00 H new ATOM 0 HB2 PHE A 55 -4.535 -15.315 -30.110 1.00 4.00 H new ATOM 0 HB3 PHE A 55 -3.045 -14.520 -30.578 1.00 4.00 H new ATOM 0 HD1 PHE A 55 -2.100 -12.703 -29.147 1.00 10.00 H new ATOM 0 HD2 PHE A 55 -5.513 -14.951 -27.957 1.00 1.00 H new ATOM 0 HE1 PHE A 55 -1.781 -11.952 -26.833 1.00 44.00 H new ATOM 0 HE2 PHE A 55 -5.204 -14.195 -25.646 1.00 44.00 H new ATOM 0 HZ PHE A 55 -3.332 -12.701 -25.074 1.00 55.00 H new ATOM 877 N TRP A 56 -4.855 -11.029 -31.143 1.00 3.00 N ATOM 878 CA TRP A 56 -4.365 -9.738 -31.345 1.00 73.00 C ATOM 879 C TRP A 56 -4.221 -9.041 -30.039 1.00 24.00 C ATOM 880 O TRP A 56 -5.174 -8.877 -29.267 1.00 50.00 O ATOM 881 CB TRP A 56 -5.250 -8.968 -32.316 1.00 74.00 C ATOM 882 CG TRP A 56 -4.934 -7.509 -32.432 1.00 11.00 C ATOM 883 CD1 TRP A 56 -3.729 -6.939 -32.720 1.00 42.00 C ATOM 884 CD2 TRP A 56 -5.861 -6.435 -32.289 1.00 10.00 C ATOM 885 NE1 TRP A 56 -3.852 -5.578 -32.724 1.00 24.00 N ATOM 886 CE2 TRP A 56 -5.155 -5.245 -32.483 1.00 53.00 C ATOM 887 CE3 TRP A 56 -7.224 -6.372 -32.009 1.00 51.00 C ATOM 888 CZ2 TRP A 56 -5.765 -3.998 -32.413 1.00 32.00 C ATOM 889 CZ3 TRP A 56 -7.833 -5.139 -31.939 1.00 34.00 C ATOM 890 CH2 TRP A 56 -7.106 -3.965 -32.142 1.00 1.00 C ATOM 0 H TRP A 56 -5.846 -11.063 -30.904 1.00 3.00 H new ATOM 0 HA TRP A 56 -3.377 -9.796 -31.801 1.00 73.00 H new ATOM 0 HB2 TRP A 56 -5.165 -9.423 -33.303 1.00 74.00 H new ATOM 0 HB3 TRP A 56 -6.289 -9.077 -32.003 1.00 74.00 H new ATOM 0 HD1 TRP A 56 -2.816 -7.481 -32.915 1.00 42.00 H new ATOM 0 HE1 TRP A 56 -3.092 -4.916 -32.882 1.00 24.00 H new ATOM 0 HE3 TRP A 56 -7.794 -7.275 -31.849 1.00 51.00 H new ATOM 0 HZ2 TRP A 56 -5.202 -3.089 -32.567 1.00 32.00 H new ATOM 0 HZ3 TRP A 56 -8.890 -5.079 -31.724 1.00 34.00 H new ATOM 0 HH2 TRP A 56 -7.611 -3.012 -32.084 1.00 1.00 H new ATOM 901 N SER A 57 -3.044 -8.675 -29.805 1.00 11.00 N ATOM 902 CA SER A 57 -2.654 -7.977 -28.644 1.00 4.00 C ATOM 903 C SER A 57 -2.357 -6.557 -29.077 1.00 72.00 C ATOM 904 O SER A 57 -1.442 -6.320 -29.876 1.00 43.00 O ATOM 905 CB SER A 57 -1.411 -8.655 -28.041 1.00 71.00 C ATOM 906 OG SER A 57 -1.002 -8.035 -26.834 1.00 43.00 O ATOM 0 H SER A 57 -2.271 -8.857 -30.445 1.00 11.00 H new ATOM 0 HA SER A 57 -3.430 -7.979 -27.878 1.00 4.00 H new ATOM 0 HB2 SER A 57 -1.627 -9.707 -27.853 1.00 71.00 H new ATOM 0 HB3 SER A 57 -0.594 -8.621 -28.761 1.00 71.00 H new ATOM 0 HG SER A 57 -0.212 -8.495 -26.482 1.00 43.00 H new ATOM 912 N LYS A 58 -3.173 -5.637 -28.646 1.00 64.00 N ATOM 913 CA LYS A 58 -2.999 -4.262 -29.012 1.00 3.00 C ATOM 914 C LYS A 58 -2.089 -3.551 -28.014 1.00 45.00 C ATOM 915 O LYS A 58 -1.334 -2.643 -28.376 1.00 20.00 O ATOM 916 CB LYS A 58 -4.367 -3.623 -29.095 1.00 44.00 C ATOM 917 CG LYS A 58 -4.398 -2.164 -29.459 1.00 24.00 C ATOM 918 CD LYS A 58 -5.827 -1.753 -29.668 1.00 24.00 C ATOM 919 CE LYS A 58 -5.981 -0.259 -29.880 1.00 61.00 C ATOM 920 NZ LYS A 58 -5.540 0.509 -28.696 1.00 43.00 N ATOM 0 H LYS A 58 -3.971 -5.818 -28.036 1.00 64.00 H new ATOM 0 HA LYS A 58 -2.510 -4.182 -29.983 1.00 3.00 H new ATOM 0 HB2 LYS A 58 -4.957 -4.172 -29.829 1.00 44.00 H new ATOM 0 HB3 LYS A 58 -4.862 -3.746 -28.132 1.00 44.00 H new ATOM 0 HG2 LYS A 58 -3.944 -1.567 -28.668 1.00 24.00 H new ATOM 0 HG3 LYS A 58 -3.817 -1.987 -30.364 1.00 24.00 H new ATOM 0 HD2 LYS A 58 -6.230 -2.282 -30.532 1.00 24.00 H new ATOM 0 HD3 LYS A 58 -6.418 -2.056 -28.804 1.00 24.00 H new ATOM 0 HE2 LYS A 58 -5.400 0.047 -30.750 1.00 61.00 H new ATOM 0 HE3 LYS A 58 -7.024 -0.028 -30.096 1.00 61.00 H new ATOM 0 HZ1 LYS A 58 -5.902 1.482 -28.759 1.00 43.00 H new ATOM 0 HZ2 LYS A 58 -5.907 0.058 -27.834 1.00 43.00 H new ATOM 0 HZ3 LYS A 58 -4.501 0.528 -28.662 1.00 43.00 H new ATOM 934 N GLY A 59 -2.121 -4.009 -26.789 1.00 25.00 N ATOM 935 CA GLY A 59 -1.329 -3.406 -25.749 1.00 32.00 C ATOM 936 C GLY A 59 -1.818 -3.838 -24.406 1.00 73.00 C ATOM 937 O GLY A 59 -1.304 -4.798 -23.833 1.00 24.00 O ATOM 0 H GLY A 59 -2.689 -4.800 -26.487 1.00 25.00 H new ATOM 0 HA2 GLY A 59 -0.283 -3.688 -25.870 1.00 32.00 H new ATOM 0 HA3 GLY A 59 -1.378 -2.320 -25.829 1.00 32.00 H new ATOM 941 N ASP A 60 -2.837 -3.161 -23.918 1.00 42.00 N ATOM 942 CA ASP A 60 -3.460 -3.525 -22.640 1.00 11.00 C ATOM 943 C ASP A 60 -4.629 -4.402 -22.910 1.00 21.00 C ATOM 944 O ASP A 60 -5.187 -4.991 -22.012 1.00 53.00 O ATOM 945 CB ASP A 60 -4.005 -2.312 -21.865 1.00 0.00 C ATOM 946 CG ASP A 60 -2.979 -1.342 -21.390 1.00 53.00 C ATOM 947 OD1 ASP A 60 -2.332 -1.593 -20.354 1.00 1.00 O ATOM 948 OD2 ASP A 60 -2.827 -0.277 -22.013 1.00 14.00 O ATOM 0 H ASP A 60 -3.259 -2.355 -24.379 1.00 42.00 H new ATOM 0 HA ASP A 60 -2.684 -4.008 -22.046 1.00 11.00 H new ATOM 0 HB2 ASP A 60 -4.712 -1.783 -22.503 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -4.564 -2.675 -21.002 1.00 0.00 H new ATOM 953 N GLU A 61 -4.986 -4.504 -24.148 1.00 60.00 N ATOM 954 CA GLU A 61 -6.165 -5.173 -24.521 1.00 3.00 C ATOM 955 C GLU A 61 -5.834 -6.232 -25.516 1.00 41.00 C ATOM 956 O GLU A 61 -4.867 -6.093 -26.304 1.00 31.00 O ATOM 957 CB GLU A 61 -7.184 -4.168 -25.058 1.00 74.00 C ATOM 958 CG GLU A 61 -6.739 -3.441 -26.304 1.00 54.00 C ATOM 959 CD GLU A 61 -7.550 -2.200 -26.587 1.00 61.00 C ATOM 960 OE1 GLU A 61 -8.781 -2.295 -26.750 1.00 14.00 O ATOM 961 OE2 GLU A 61 -6.964 -1.083 -26.632 1.00 20.00 O ATOM 0 H GLU A 61 -4.455 -4.118 -24.928 1.00 60.00 H new ATOM 0 HA GLU A 61 -6.617 -5.658 -23.656 1.00 3.00 H new ATOM 0 HB2 GLU A 61 -8.117 -4.691 -25.270 1.00 74.00 H new ATOM 0 HB3 GLU A 61 -7.399 -3.435 -24.280 1.00 74.00 H new ATOM 0 HG2 GLU A 61 -5.689 -3.166 -26.202 1.00 54.00 H new ATOM 0 HG3 GLU A 61 -6.810 -4.116 -27.157 1.00 54.00 H new ATOM 968 N ALA A 62 -6.589 -7.274 -25.480 1.00 64.00 N ATOM 969 CA ALA A 62 -6.383 -8.379 -26.307 1.00 54.00 C ATOM 970 C ALA A 62 -7.720 -8.827 -26.831 1.00 24.00 C ATOM 971 O ALA A 62 -8.736 -8.770 -26.117 1.00 24.00 O ATOM 972 CB ALA A 62 -5.726 -9.501 -25.524 1.00 12.00 C ATOM 0 H ALA A 62 -7.386 -7.370 -24.851 1.00 64.00 H new ATOM 0 HA ALA A 62 -5.726 -8.112 -27.135 1.00 54.00 H new ATOM 0 HB1 ALA A 62 -5.570 -10.358 -26.179 1.00 12.00 H new ATOM 0 HB2 ALA A 62 -4.766 -9.160 -25.136 1.00 12.00 H new ATOM 0 HB3 ALA A 62 -6.370 -9.791 -24.694 1.00 12.00 H new ATOM 978 N THR A 63 -7.745 -9.189 -28.052 1.00 62.00 N ATOM 979 CA THR A 63 -8.933 -9.698 -28.692 1.00 14.00 C ATOM 980 C THR A 63 -8.555 -10.799 -29.697 1.00 74.00 C ATOM 981 O THR A 63 -7.512 -10.726 -30.341 1.00 31.00 O ATOM 982 CB THR A 63 -9.712 -8.548 -29.374 1.00 41.00 C ATOM 983 OG1 THR A 63 -10.053 -7.564 -28.380 1.00 72.00 O ATOM 984 CG2 THR A 63 -10.984 -9.049 -30.026 1.00 63.00 C ATOM 0 H THR A 63 -6.932 -9.147 -28.666 1.00 62.00 H new ATOM 0 HA THR A 63 -9.588 -10.138 -27.940 1.00 14.00 H new ATOM 0 HB THR A 63 -9.078 -8.116 -30.149 1.00 41.00 H new ATOM 0 HG1 THR A 63 -10.546 -6.830 -28.802 1.00 72.00 H new ATOM 0 HG21 THR A 63 -11.505 -8.215 -30.495 1.00 63.00 H new ATOM 0 HG22 THR A 63 -10.736 -9.793 -30.783 1.00 63.00 H new ATOM 0 HG23 THR A 63 -11.627 -9.500 -29.270 1.00 63.00 H new ATOM 992 N VAL A 64 -9.383 -11.822 -29.791 1.00 73.00 N ATOM 993 CA VAL A 64 -9.106 -12.970 -30.635 1.00 73.00 C ATOM 994 C VAL A 64 -10.195 -13.123 -31.692 1.00 31.00 C ATOM 995 O VAL A 64 -11.318 -13.481 -31.360 1.00 12.00 O ATOM 996 CB VAL A 64 -9.054 -14.263 -29.799 1.00 31.00 C ATOM 997 CG1 VAL A 64 -8.623 -15.432 -30.637 1.00 41.00 C ATOM 998 CG2 VAL A 64 -8.183 -14.123 -28.564 1.00 72.00 C ATOM 0 H VAL A 64 -10.267 -11.881 -29.285 1.00 73.00 H new ATOM 0 HA VAL A 64 -8.140 -12.805 -31.113 1.00 73.00 H new ATOM 0 HB VAL A 64 -10.068 -14.451 -29.447 1.00 31.00 H new ATOM 0 HG11 VAL A 64 -8.595 -16.331 -30.021 1.00 41.00 H new ATOM 0 HG12 VAL A 64 -9.330 -15.574 -31.454 1.00 41.00 H new ATOM 0 HG13 VAL A 64 -7.630 -15.241 -31.045 1.00 41.00 H new ATOM 0 HG21 VAL A 64 -8.182 -15.063 -28.011 1.00 72.00 H new ATOM 0 HG22 VAL A 64 -7.164 -13.876 -28.863 1.00 72.00 H new ATOM 0 HG23 VAL A 64 -8.577 -13.329 -27.929 1.00 72.00 H new ATOM 1008 N TYR A 65 -9.849 -12.898 -32.946 1.00 14.00 N ATOM 1009 CA TYR A 65 -10.834 -12.917 -34.033 1.00 71.00 C ATOM 1010 C TYR A 65 -10.505 -13.946 -35.133 1.00 74.00 C ATOM 1011 O TYR A 65 -9.610 -13.712 -35.915 1.00 62.00 O ATOM 1012 CB TYR A 65 -10.798 -11.591 -34.826 1.00 5.00 C ATOM 1013 CG TYR A 65 -11.049 -10.261 -34.157 1.00 61.00 C ATOM 1014 CD1 TYR A 65 -12.333 -9.778 -33.970 1.00 61.00 C ATOM 1015 CD2 TYR A 65 -9.984 -9.445 -33.807 1.00 4.00 C ATOM 1016 CE1 TYR A 65 -12.551 -8.517 -33.446 1.00 43.00 C ATOM 1017 CE2 TYR A 65 -10.191 -8.194 -33.274 1.00 25.00 C ATOM 1018 CZ TYR A 65 -11.474 -7.732 -33.099 1.00 64.00 C ATOM 1019 OH TYR A 65 -11.680 -6.477 -32.570 1.00 73.00 O ATOM 0 H TYR A 65 -8.895 -12.699 -33.246 1.00 14.00 H new ATOM 0 HA TYR A 65 -11.777 -13.128 -33.529 1.00 71.00 H new ATOM 0 HB2 TYR A 65 -9.815 -11.529 -35.294 1.00 5.00 H new ATOM 0 HB3 TYR A 65 -11.528 -11.683 -35.630 1.00 5.00 H new ATOM 0 HD1 TYR A 65 -13.178 -10.396 -34.238 1.00 61.00 H new ATOM 0 HD2 TYR A 65 -8.974 -9.798 -33.956 1.00 4.00 H new ATOM 0 HE1 TYR A 65 -13.558 -8.151 -33.310 1.00 43.00 H new ATOM 0 HE2 TYR A 65 -9.350 -7.577 -32.994 1.00 25.00 H new ATOM 0 HH TYR A 65 -10.816 -6.057 -32.379 1.00 73.00 H new ATOM 1029 N LYS A 66 -11.170 -15.061 -35.196 1.00 44.00 N ATOM 1030 CA LYS A 66 -11.248 -15.740 -36.421 1.00 24.00 C ATOM 1031 C LYS A 66 -12.486 -15.134 -37.029 1.00 4.00 C ATOM 1032 O LYS A 66 -13.378 -14.726 -36.292 1.00 0.00 O ATOM 1033 CB LYS A 66 -11.396 -17.269 -36.246 1.00 71.00 C ATOM 1034 CG LYS A 66 -11.662 -18.058 -37.539 1.00 63.00 C ATOM 1035 CD LYS A 66 -10.602 -17.841 -38.634 1.00 22.00 C ATOM 1036 CE LYS A 66 -9.260 -18.517 -38.353 1.00 75.00 C ATOM 1037 NZ LYS A 66 -9.349 -19.996 -38.384 1.00 11.00 N ATOM 0 H LYS A 66 -11.655 -15.502 -34.415 1.00 44.00 H new ATOM 0 HA LYS A 66 -10.349 -15.633 -37.029 1.00 24.00 H new ATOM 0 HB2 LYS A 66 -10.486 -17.655 -35.786 1.00 71.00 H new ATOM 0 HB3 LYS A 66 -12.212 -17.461 -35.549 1.00 71.00 H new ATOM 0 HG2 LYS A 66 -11.711 -19.120 -37.301 1.00 63.00 H new ATOM 0 HG3 LYS A 66 -12.638 -17.774 -37.931 1.00 63.00 H new ATOM 0 HD2 LYS A 66 -10.993 -18.215 -39.581 1.00 22.00 H new ATOM 0 HD3 LYS A 66 -10.438 -16.771 -38.757 1.00 22.00 H new ATOM 0 HE2 LYS A 66 -8.529 -18.185 -39.090 1.00 75.00 H new ATOM 0 HE3 LYS A 66 -8.895 -18.199 -37.376 1.00 75.00 H new ATOM 0 HZ1 LYS A 66 -8.475 -20.388 -38.790 1.00 11.00 H new ATOM 0 HZ2 LYS A 66 -9.473 -20.357 -37.417 1.00 11.00 H new ATOM 0 HZ3 LYS A 66 -10.161 -20.283 -38.967 1.00 11.00 H new ATOM 1051 N ARG A 67 -12.508 -15.055 -38.302 1.00 53.00 N ATOM 1052 CA ARG A 67 -13.567 -14.428 -39.105 1.00 5.00 C ATOM 1053 C ARG A 67 -14.983 -14.788 -38.611 1.00 3.00 C ATOM 1054 O ARG A 67 -15.878 -13.944 -38.598 1.00 44.00 O ATOM 1055 CB ARG A 67 -13.346 -14.815 -40.604 1.00 11.00 C ATOM 1056 CG ARG A 67 -14.289 -14.176 -41.639 1.00 34.00 C ATOM 1057 CD ARG A 67 -15.674 -14.792 -41.625 1.00 35.00 C ATOM 1058 NE ARG A 67 -16.603 -14.105 -42.522 1.00 31.00 N ATOM 1059 CZ ARG A 67 -17.853 -13.722 -42.201 1.00 72.00 C ATOM 1060 NH1 ARG A 67 -18.320 -13.888 -40.956 1.00 34.00 N ATOM 1061 NH2 ARG A 67 -18.613 -13.143 -43.115 1.00 35.00 N ATOM 0 H ARG A 67 -11.758 -15.439 -38.878 1.00 53.00 H new ATOM 0 HA ARG A 67 -13.500 -13.346 -38.996 1.00 5.00 H new ATOM 0 HB2 ARG A 67 -12.322 -14.555 -40.873 1.00 11.00 H new ATOM 0 HB3 ARG A 67 -13.433 -15.898 -40.690 1.00 11.00 H new ATOM 0 HG2 ARG A 67 -14.369 -13.107 -41.441 1.00 34.00 H new ATOM 0 HG3 ARG A 67 -13.857 -14.284 -42.634 1.00 34.00 H new ATOM 0 HD2 ARG A 67 -15.604 -15.841 -41.914 1.00 35.00 H new ATOM 0 HD3 ARG A 67 -16.069 -14.766 -40.609 1.00 35.00 H new ATOM 0 HE ARG A 67 -16.278 -13.900 -43.467 1.00 31.00 H new ATOM 0 HH11 ARG A 67 -17.727 -14.308 -40.241 1.00 34.00 H new ATOM 0 HH12 ARG A 67 -19.269 -13.594 -40.724 1.00 34.00 H new ATOM 0 HH21 ARG A 67 -18.251 -12.989 -44.056 1.00 35.00 H new ATOM 0 HH22 ARG A 67 -19.561 -12.850 -42.879 1.00 35.00 H new ATOM 1075 N ASP A 68 -15.180 -16.012 -38.211 1.00 64.00 N ATOM 1076 CA ASP A 68 -16.494 -16.440 -37.778 1.00 43.00 C ATOM 1077 C ASP A 68 -16.469 -16.775 -36.298 1.00 2.00 C ATOM 1078 O ASP A 68 -17.488 -17.112 -35.708 1.00 2.00 O ATOM 1079 CB ASP A 68 -16.933 -17.661 -38.604 1.00 42.00 C ATOM 1080 CG ASP A 68 -18.369 -18.104 -38.377 1.00 34.00 C ATOM 1081 OD1 ASP A 68 -19.280 -17.541 -39.025 1.00 43.00 O ATOM 1082 OD2 ASP A 68 -18.603 -19.071 -37.613 1.00 55.00 O ATOM 0 H ASP A 68 -14.458 -16.732 -38.173 1.00 64.00 H new ATOM 0 HA ASP A 68 -17.210 -15.633 -37.934 1.00 43.00 H new ATOM 0 HB2 ASP A 68 -16.802 -17.432 -39.662 1.00 42.00 H new ATOM 0 HB3 ASP A 68 -16.270 -18.495 -38.373 1.00 42.00 H new ATOM 1087 N ARG A 69 -15.311 -16.633 -35.663 1.00 53.00 N ATOM 1088 CA ARG A 69 -15.224 -17.052 -34.305 1.00 74.00 C ATOM 1089 C ARG A 69 -14.244 -16.233 -33.469 1.00 43.00 C ATOM 1090 O ARG A 69 -13.037 -16.490 -33.437 1.00 10.00 O ATOM 1091 CB ARG A 69 -14.928 -18.551 -34.204 1.00 13.00 C ATOM 1092 CG ARG A 69 -14.914 -19.132 -32.782 1.00 4.00 C ATOM 1093 CD ARG A 69 -16.299 -19.123 -32.113 1.00 13.00 C ATOM 1094 NE ARG A 69 -16.705 -17.793 -31.631 1.00 73.00 N ATOM 1095 CZ ARG A 69 -17.937 -17.264 -31.717 1.00 11.00 C ATOM 1096 NH1 ARG A 69 -18.905 -17.881 -32.394 1.00 14.00 N ATOM 1097 NH2 ARG A 69 -18.184 -16.091 -31.139 1.00 10.00 N ATOM 0 H ARG A 69 -14.458 -16.243 -36.065 1.00 53.00 H new ATOM 0 HA ARG A 69 -16.207 -16.864 -33.873 1.00 74.00 H new ATOM 0 HB2 ARG A 69 -15.673 -19.090 -34.790 1.00 13.00 H new ATOM 0 HB3 ARG A 69 -13.959 -18.743 -34.665 1.00 13.00 H new ATOM 0 HG2 ARG A 69 -14.541 -20.156 -32.818 1.00 4.00 H new ATOM 0 HG3 ARG A 69 -14.217 -18.560 -32.169 1.00 4.00 H new ATOM 0 HD2 ARG A 69 -17.041 -19.486 -32.825 1.00 13.00 H new ATOM 0 HD3 ARG A 69 -16.294 -19.820 -31.275 1.00 13.00 H new ATOM 0 HE ARG A 69 -15.985 -17.220 -31.191 1.00 73.00 H new ATOM 0 HH11 ARG A 69 -18.716 -18.770 -32.858 1.00 14.00 H new ATOM 0 HH12 ARG A 69 -19.834 -17.464 -32.449 1.00 14.00 H new ATOM 0 HH21 ARG A 69 -17.442 -15.603 -30.637 1.00 10.00 H new ATOM 0 HH22 ARG A 69 -19.116 -15.680 -31.198 1.00 10.00 H new ATOM 1111 N ILE A 70 -14.760 -15.197 -32.897 1.00 73.00 N ATOM 1112 CA ILE A 70 -14.099 -14.477 -31.845 1.00 62.00 C ATOM 1113 C ILE A 70 -14.308 -15.276 -30.615 1.00 75.00 C ATOM 1114 O ILE A 70 -15.426 -15.698 -30.315 1.00 71.00 O ATOM 1115 CB ILE A 70 -14.735 -13.102 -31.616 1.00 42.00 C ATOM 1116 CG1 ILE A 70 -14.720 -12.281 -32.878 1.00 51.00 C ATOM 1117 CG2 ILE A 70 -14.069 -12.347 -30.459 1.00 64.00 C ATOM 1118 CD1 ILE A 70 -15.500 -10.981 -32.788 1.00 24.00 C ATOM 0 H ILE A 70 -15.671 -14.814 -33.148 1.00 73.00 H new ATOM 0 HA ILE A 70 -13.050 -14.329 -32.100 1.00 62.00 H new ATOM 0 HB ILE A 70 -15.774 -13.271 -31.334 1.00 42.00 H new ATOM 0 HG12 ILE A 70 -13.686 -12.053 -33.137 1.00 51.00 H new ATOM 0 HG13 ILE A 70 -15.128 -12.880 -33.692 1.00 51.00 H new ATOM 0 HG21 ILE A 70 -14.551 -11.378 -30.332 1.00 64.00 H new ATOM 0 HG22 ILE A 70 -14.170 -12.926 -29.541 1.00 64.00 H new ATOM 0 HG23 ILE A 70 -13.012 -12.200 -30.681 1.00 64.00 H new ATOM 0 HD11 ILE A 70 -15.437 -10.452 -33.739 1.00 24.00 H new ATOM 0 HD12 ILE A 70 -16.544 -11.198 -32.562 1.00 24.00 H new ATOM 0 HD13 ILE A 70 -15.080 -10.358 -31.998 1.00 24.00 H new ATOM 1130 N VAL A 71 -13.281 -15.506 -29.943 1.00 54.00 N ATOM 1131 CA VAL A 71 -13.361 -16.282 -28.745 1.00 11.00 C ATOM 1132 C VAL A 71 -13.283 -15.413 -27.523 1.00 54.00 C ATOM 1133 O VAL A 71 -13.913 -15.701 -26.511 1.00 31.00 O ATOM 1134 CB VAL A 71 -12.385 -17.487 -28.704 1.00 12.00 C ATOM 1135 CG1 VAL A 71 -12.750 -18.456 -29.798 1.00 34.00 C ATOM 1136 CG2 VAL A 71 -10.960 -17.062 -28.883 1.00 60.00 C ATOM 0 H VAL A 71 -12.346 -15.175 -30.182 1.00 54.00 H new ATOM 0 HA VAL A 71 -14.348 -16.744 -28.748 1.00 11.00 H new ATOM 0 HB VAL A 71 -12.475 -17.956 -27.724 1.00 12.00 H new ATOM 0 HG11 VAL A 71 -12.067 -19.305 -29.774 1.00 34.00 H new ATOM 0 HG12 VAL A 71 -13.771 -18.807 -29.648 1.00 34.00 H new ATOM 0 HG13 VAL A 71 -12.676 -17.958 -30.765 1.00 34.00 H new ATOM 0 HG21 VAL A 71 -10.312 -17.938 -28.847 1.00 60.00 H new ATOM 0 HG22 VAL A 71 -10.847 -16.566 -29.847 1.00 60.00 H new ATOM 0 HG23 VAL A 71 -10.683 -16.373 -28.085 1.00 60.00 H new ATOM 1146 N LEU A 72 -12.600 -14.291 -27.661 1.00 61.00 N ATOM 1147 CA LEU A 72 -12.428 -13.338 -26.558 1.00 21.00 C ATOM 1148 C LEU A 72 -12.323 -11.947 -27.136 1.00 32.00 C ATOM 1149 O LEU A 72 -11.654 -11.763 -28.164 1.00 61.00 O ATOM 1150 CB LEU A 72 -11.172 -13.602 -25.664 1.00 11.00 C ATOM 1151 CG LEU A 72 -11.111 -14.879 -24.792 1.00 64.00 C ATOM 1152 CD1 LEU A 72 -10.684 -16.108 -25.558 1.00 22.00 C ATOM 1153 CD2 LEU A 72 -10.224 -14.670 -23.599 1.00 72.00 C ATOM 0 H LEU A 72 -12.148 -14.008 -28.531 1.00 61.00 H new ATOM 0 HA LEU A 72 -13.297 -13.457 -25.911 1.00 21.00 H new ATOM 0 HB2 LEU A 72 -10.301 -13.612 -26.319 1.00 11.00 H new ATOM 0 HB3 LEU A 72 -11.060 -12.746 -24.998 1.00 11.00 H new ATOM 0 HG LEU A 72 -12.131 -15.063 -24.454 1.00 64.00 H new ATOM 0 HD11 LEU A 72 -10.663 -16.966 -24.886 1.00 22.00 H new ATOM 0 HD12 LEU A 72 -11.391 -16.297 -26.366 1.00 22.00 H new ATOM 0 HD13 LEU A 72 -9.690 -15.949 -25.976 1.00 22.00 H new ATOM 0 HD21 LEU A 72 -10.197 -15.581 -23.001 1.00 72.00 H new ATOM 0 HD22 LEU A 72 -9.216 -14.426 -23.934 1.00 72.00 H new ATOM 0 HD23 LEU A 72 -10.614 -13.851 -22.995 1.00 72.00 H new ATOM 1165 N ASN A 73 -12.971 -10.975 -26.511 1.00 62.00 N ATOM 1166 CA ASN A 73 -12.963 -9.593 -27.032 1.00 72.00 C ATOM 1167 C ASN A 73 -12.991 -8.559 -25.920 1.00 15.00 C ATOM 1168 O ASN A 73 -13.232 -7.361 -26.153 1.00 14.00 O ATOM 1169 CB ASN A 73 -14.120 -9.372 -28.027 1.00 73.00 C ATOM 1170 CG ASN A 73 -15.509 -9.343 -27.384 1.00 23.00 C ATOM 1171 OD1 ASN A 73 -15.743 -9.908 -26.307 1.00 45.00 O ATOM 1172 ND2 ASN A 73 -16.441 -8.741 -28.056 1.00 54.00 N ATOM 0 H ASN A 73 -13.506 -11.103 -25.652 1.00 62.00 H new ATOM 0 HA ASN A 73 -12.023 -9.458 -27.566 1.00 72.00 H new ATOM 0 HB2 ASN A 73 -13.956 -8.431 -28.553 1.00 73.00 H new ATOM 0 HB3 ASN A 73 -14.096 -10.164 -28.776 1.00 73.00 H new ATOM 0 HD21 ASN A 73 -17.397 -8.724 -27.700 1.00 54.00 H new ATOM 0 HD22 ASN A 73 -16.218 -8.284 -28.940 1.00 54.00 H new ATOM 1179 N ASN A 74 -12.665 -8.998 -24.749 1.00 54.00 N ATOM 1180 CA ASN A 74 -12.650 -8.157 -23.583 1.00 63.00 C ATOM 1181 C ASN A 74 -11.667 -8.722 -22.610 1.00 50.00 C ATOM 1182 O ASN A 74 -12.012 -9.518 -21.740 1.00 51.00 O ATOM 1183 CB ASN A 74 -14.040 -7.999 -22.931 1.00 50.00 C ATOM 1184 CG ASN A 74 -14.015 -7.087 -21.699 1.00 0.00 C ATOM 1185 OD1 ASN A 74 -13.801 -7.537 -20.580 1.00 54.00 O ATOM 1186 ND2 ASN A 74 -14.239 -5.816 -21.895 1.00 35.00 N ATOM 0 H ASN A 74 -12.396 -9.965 -24.566 1.00 54.00 H new ATOM 0 HA ASN A 74 -12.355 -7.153 -23.889 1.00 63.00 H new ATOM 0 HB2 ASN A 74 -14.737 -7.593 -23.664 1.00 50.00 H new ATOM 0 HB3 ASN A 74 -14.416 -8.981 -22.644 1.00 50.00 H new ATOM 0 HD21 ASN A 74 -14.239 -5.170 -21.105 1.00 35.00 H new ATOM 0 HD22 ASN A 74 -14.414 -5.469 -22.838 1.00 35.00 H new ATOM 1193 N CYS A 75 -10.440 -8.407 -22.856 1.00 35.00 N ATOM 1194 CA CYS A 75 -9.347 -8.815 -22.036 1.00 13.00 C ATOM 1195 C CYS A 75 -8.457 -7.656 -21.869 1.00 3.00 C ATOM 1196 O CYS A 75 -8.145 -6.967 -22.853 1.00 64.00 O ATOM 1197 CB CYS A 75 -8.582 -9.972 -22.659 1.00 12.00 C ATOM 1198 SG CYS A 75 -9.498 -11.525 -22.680 1.00 41.00 S ATOM 0 H CYS A 75 -10.160 -7.841 -23.657 1.00 35.00 H new ATOM 0 HA CYS A 75 -9.724 -9.161 -21.074 1.00 13.00 H new ATOM 0 HB2 CYS A 75 -8.311 -9.707 -23.681 1.00 12.00 H new ATOM 0 HB3 CYS A 75 -7.652 -10.117 -22.110 1.00 12.00 H new ATOM 1203 N GLN A 76 -8.058 -7.421 -20.667 1.00 25.00 N ATOM 1204 CA GLN A 76 -7.265 -6.313 -20.331 1.00 13.00 C ATOM 1205 C GLN A 76 -6.206 -6.807 -19.444 1.00 42.00 C ATOM 1206 O GLN A 76 -6.459 -7.409 -18.421 1.00 62.00 O ATOM 1207 CB GLN A 76 -8.104 -5.196 -19.735 1.00 22.00 C ATOM 1208 CG GLN A 76 -9.005 -4.550 -20.783 1.00 54.00 C ATOM 1209 CD GLN A 76 -9.920 -3.497 -20.218 1.00 35.00 C ATOM 1210 OE1 GLN A 76 -9.604 -2.842 -19.218 1.00 13.00 O ATOM 1211 NE2 GLN A 76 -11.032 -3.284 -20.870 1.00 33.00 N ATOM 0 H GLN A 76 -8.287 -8.019 -19.873 1.00 25.00 H new ATOM 0 HA GLN A 76 -6.806 -5.860 -21.210 1.00 13.00 H new ATOM 0 HB2 GLN A 76 -8.715 -5.592 -18.924 1.00 22.00 H new ATOM 0 HB3 GLN A 76 -7.449 -4.440 -19.301 1.00 22.00 H new ATOM 0 HG2 GLN A 76 -8.384 -4.103 -21.559 1.00 54.00 H new ATOM 0 HG3 GLN A 76 -9.605 -5.324 -21.262 1.00 54.00 H new ATOM 0 HE21 GLN A 76 -11.257 -3.846 -21.691 1.00 33.00 H new ATOM 0 HE22 GLN A 76 -11.675 -2.556 -20.558 1.00 33.00 H new ATOM 1220 N LEU A 77 -5.039 -6.651 -19.894 1.00 3.00 N ATOM 1221 CA LEU A 77 -3.929 -7.274 -19.301 1.00 71.00 C ATOM 1222 C LEU A 77 -3.278 -6.452 -18.182 1.00 25.00 C ATOM 1223 O LEU A 77 -2.974 -5.270 -18.365 1.00 22.00 O ATOM 1224 CB LEU A 77 -2.933 -7.652 -20.395 1.00 23.00 C ATOM 1225 CG LEU A 77 -1.582 -8.229 -19.971 1.00 14.00 C ATOM 1226 CD1 LEU A 77 -1.763 -9.416 -19.053 1.00 52.00 C ATOM 1227 CD2 LEU A 77 -0.779 -8.605 -21.207 1.00 42.00 C ATOM 0 H LEU A 77 -4.814 -6.074 -20.705 1.00 3.00 H new ATOM 0 HA LEU A 77 -4.281 -8.175 -18.798 1.00 71.00 H new ATOM 0 HB2 LEU A 77 -3.416 -8.379 -21.049 1.00 23.00 H new ATOM 0 HB3 LEU A 77 -2.742 -6.762 -20.994 1.00 23.00 H new ATOM 0 HG LEU A 77 -1.032 -7.471 -19.413 1.00 14.00 H new ATOM 0 HD11 LEU A 77 -0.787 -9.807 -18.767 1.00 52.00 H new ATOM 0 HD12 LEU A 77 -2.306 -9.106 -18.160 1.00 52.00 H new ATOM 0 HD13 LEU A 77 -2.327 -10.192 -19.569 1.00 52.00 H new ATOM 0 HD21 LEU A 77 0.184 -9.016 -20.904 1.00 42.00 H new ATOM 0 HD22 LEU A 77 -1.327 -9.350 -21.784 1.00 42.00 H new ATOM 0 HD23 LEU A 77 -0.618 -7.718 -21.820 1.00 42.00 H new ATOM 1239 N GLN A 78 -3.072 -7.092 -17.030 1.00 24.00 N ATOM 1240 CA GLN A 78 -2.342 -6.480 -15.918 1.00 31.00 C ATOM 1241 C GLN A 78 -0.860 -6.367 -16.258 1.00 74.00 C ATOM 1242 O GLN A 78 -0.341 -5.277 -16.440 1.00 64.00 O ATOM 1243 CB GLN A 78 -2.502 -7.318 -14.646 1.00 62.00 C ATOM 1244 CG GLN A 78 -3.906 -7.337 -14.101 1.00 70.00 C ATOM 1245 CD GLN A 78 -4.338 -5.996 -13.549 1.00 60.00 C ATOM 1246 OE1 GLN A 78 -3.530 -5.231 -13.026 1.00 64.00 O ATOM 1247 NE2 GLN A 78 -5.576 -5.680 -13.708 1.00 43.00 N ATOM 0 H GLN A 78 -3.402 -8.039 -16.842 1.00 24.00 H new ATOM 0 HA GLN A 78 -2.754 -5.485 -15.748 1.00 31.00 H new ATOM 0 HB2 GLN A 78 -2.190 -8.341 -14.855 1.00 62.00 H new ATOM 0 HB3 GLN A 78 -1.830 -6.930 -13.880 1.00 62.00 H new ATOM 0 HG2 GLN A 78 -4.594 -7.638 -14.891 1.00 70.00 H new ATOM 0 HG3 GLN A 78 -3.976 -8.088 -13.314 1.00 70.00 H new ATOM 0 HE21 GLN A 78 -6.219 -6.340 -14.146 1.00 43.00 H new ATOM 0 HE22 GLN A 78 -5.914 -4.770 -13.396 1.00 43.00 H new ATOM 1256 N ASN A 79 -0.218 -7.514 -16.383 1.00 64.00 N ATOM 1257 CA ASN A 79 1.190 -7.645 -16.649 1.00 54.00 C ATOM 1258 C ASN A 79 1.339 -9.097 -16.943 1.00 44.00 C ATOM 1259 O ASN A 79 0.869 -9.904 -16.148 1.00 74.00 O ATOM 1260 CB ASN A 79 2.021 -7.291 -15.381 1.00 4.00 C ATOM 1261 CG ASN A 79 3.548 -7.405 -15.561 1.00 43.00 C ATOM 1262 OD1 ASN A 79 4.055 -8.171 -16.383 1.00 54.00 O ATOM 1263 ND2 ASN A 79 4.288 -6.667 -14.777 1.00 62.00 N ATOM 0 H ASN A 79 -0.690 -8.414 -16.297 1.00 64.00 H new ATOM 0 HA ASN A 79 1.534 -6.990 -17.449 1.00 54.00 H new ATOM 0 HB2 ASN A 79 1.779 -6.272 -15.077 1.00 4.00 H new ATOM 0 HB3 ASN A 79 1.714 -7.948 -14.567 1.00 4.00 H new ATOM 0 HD21 ASN A 79 5.305 -6.718 -14.839 1.00 62.00 H new ATOM 0 HD22 ASN A 79 3.849 -6.039 -14.103 1.00 62.00 H new ATOM 1270 N PRO A 80 1.875 -9.486 -18.098 1.00 43.00 N ATOM 1271 CA PRO A 80 2.018 -10.895 -18.430 1.00 55.00 C ATOM 1272 C PRO A 80 2.897 -11.676 -17.426 1.00 41.00 C ATOM 1273 O PRO A 80 2.704 -12.866 -17.203 1.00 42.00 O ATOM 1274 CB PRO A 80 2.629 -10.899 -19.831 1.00 61.00 C ATOM 1275 CG PRO A 80 3.205 -9.534 -19.995 1.00 22.00 C ATOM 1276 CD PRO A 80 2.312 -8.626 -19.211 1.00 1.00 C ATOM 0 HA PRO A 80 1.056 -11.405 -18.387 1.00 55.00 H new ATOM 0 HB2 PRO A 80 3.397 -11.667 -19.926 1.00 61.00 H new ATOM 0 HB3 PRO A 80 1.876 -11.105 -20.591 1.00 61.00 H new ATOM 0 HG2 PRO A 80 4.229 -9.493 -19.624 1.00 22.00 H new ATOM 0 HG3 PRO A 80 3.235 -9.244 -21.045 1.00 22.00 H new ATOM 0 HD2 PRO A 80 2.843 -7.743 -18.856 1.00 1.00 H new ATOM 0 HD3 PRO A 80 1.469 -8.274 -19.806 1.00 1.00 H new ATOM 1284 N GLN A 81 3.820 -10.997 -16.803 1.00 12.00 N ATOM 1285 CA GLN A 81 4.671 -11.602 -15.837 1.00 43.00 C ATOM 1286 C GLN A 81 4.351 -11.069 -14.452 1.00 24.00 C ATOM 1287 O GLN A 81 5.199 -10.520 -13.730 1.00 72.00 O ATOM 1288 CB GLN A 81 6.134 -11.462 -16.209 1.00 1.00 C ATOM 1289 CG GLN A 81 6.567 -10.044 -16.513 1.00 44.00 C ATOM 1290 CD GLN A 81 8.016 -9.938 -16.907 1.00 32.00 C ATOM 1291 OE1 GLN A 81 8.370 -10.019 -18.094 1.00 42.00 O ATOM 1292 NE2 GLN A 81 8.866 -9.772 -15.932 1.00 75.00 N ATOM 0 H GLN A 81 3.998 -10.005 -16.957 1.00 12.00 H new ATOM 0 HA GLN A 81 4.478 -12.675 -15.822 1.00 43.00 H new ATOM 0 HB2 GLN A 81 6.743 -11.848 -15.392 1.00 1.00 H new ATOM 0 HB3 GLN A 81 6.337 -12.086 -17.080 1.00 1.00 H new ATOM 0 HG2 GLN A 81 5.948 -9.647 -17.318 1.00 44.00 H new ATOM 0 HG3 GLN A 81 6.389 -9.421 -15.637 1.00 44.00 H new ATOM 0 HE21 GLN A 81 8.533 -9.710 -14.970 1.00 75.00 H new ATOM 0 HE22 GLN A 81 9.864 -9.704 -16.132 1.00 75.00 H new